Natural Product: NPC281104

Natural Product ID:  NPC281104
Common Name:   Cocaine
IUPAC Name:   methyl (1S,3S,4R,5R)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-4-carboxylate
Synonyms:   Cocaine
Molecular Formula:   C17H21NO4
Standard InCHIKey:  ZPUCINDJVBIVPJ-LJISPDSOSA-N
Standard InCHI:  InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1
Canonical SMILES:  COC(=O)[C@H]1[C@H](C[C@H]2N([C@@H]1CC2)C)OC(=O)c1ccccc1
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO20338 Mus musculus Species Muridae Eukaryota PMID[19425150]
NPO3735 Erythroxylum coca Species Erythroxylaceae Eukaryota PMID[25303034]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 11277529
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 208 nM 11277529
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 580 nM 1469704
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 570 nM 1469704
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 1.7 mg/kg 1469704
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 32 nM 8691489
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 388 nM 8691489
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 405 nM 8691489
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 101 nM 9526561
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 209 nM 9526561
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 187 nM 12801223
NPT296 Individual Protein Sigma opioid receptor Homo sapiens Ki = 8830 nM 12801223
NPT2 Others Unspecified Ratio = 47 12801223
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 259 nM 12109901
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 12109901
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 12109901
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.6 12109901
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 0.42 12109901
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 0.7 12109901
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 231 nM 10669562
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 274 nM 10669562
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 10669562
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 10669562
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 221 nM 1920365
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 207 nM 1920365
NPT2 Others Unspecified Ki = 230 nM 11354356
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 270 nM 11354356
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 160 nM 11354356
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 190 nM 11354356
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 297 nM 11354356
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 12723962
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 12723962
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 12723962
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.37 12723962
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 0.26 12723962
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 0.7 12723962
NPT5678 Individual Protein Dopamine transporter Macaca fascicularis IC50 = 95.6 nM 10206550
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 270 nM 10206550
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 82 nM 8258830
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 179 nM 8258830
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 296 nM 8258830
NPT1496 Protein Complex Glutamate NMDA receptor Rattus norvegicus Ki > 10000 nM 8258830
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ratio = 1.8 8258830
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ratio = 4.7 8258830
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 9083474
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 388 nM 9083474
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 405 nM 9083474
NPT32 Organism Mus musculus Mus musculus ED50 = 20.79 umol/kg 9083474
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 8.74 umol/kg 9083474
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 320 nM 8254627
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 280 nM 8254627
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 336 nM 8254627
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 8941387
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 390 nM 8941387
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 459 nM 10737754
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 10737754
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 127 nM 10737754
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 10737754
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 168 nM 10737754
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 10737754
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 270 nM 12565962
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 155 nM 12565962
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 108 nM 12565962
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 160 nM 10579846
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 10579846
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 10579846
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 404 nM 10579846
NPT2 Others Unspecified Ratio = 21 10579846
NPT5679 Others Monoamine transporters; serotonin & dopamine Homo sapiens Ratio = 6.6 10579846
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 2002468
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Potency = 100 % 2002468
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 230 nM 11334571
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 11334571
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 11334571
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 11334571
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 15800 nM 2002468
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Potency = 0.65 % 2002468
NPT2762 Organism Monkey Cercopithecidae IC50 = 70 nM 1613745
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 139 nM 1552510
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 150 nM 1552510
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 1810 nM 1552510
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 66 nM 1552510
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 1450 nM 1552510
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 843 nM 1552510
NPT98 Individual Protein HERG Homo sapiens IC50 = 4.4 nM 12190308
NPT1790 Individual Protein Dopamine transporter Bos taurus IC50 = 65 nM 1995895
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 213 nM 1995895
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 8164265
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 8164265
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3298 nM 8164265
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 12 8164265
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 37 8164265
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 7830281
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3298 nM 7830281
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 7830281
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 241.3 nM 7830281
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 160.55 nM 7830281
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 112.11 nM 7830281
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 37 7830281
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 12 7830281
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 0.69 7830281
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.46 7830281
NPT1774 Protein Family Sodium channel alpha subunits; brain (Types I, II, III) Homo sapiens IC50 = 49000 nM 2579237
NPT1774 Protein Family Sodium channel alpha subunits; brain (Types I, II, III) Homo sapiens Inhibition = 19.5 % 2579237
NPT1774 Protein Family Sodium channel alpha subunits; brain (Types I, II, III) Homo sapiens Inhibition = 63.2 % 2579237
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 9435910
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 338 nM 9435910
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 405 nM 9435910
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 8831768
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 8831768
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3298 nM 8831768
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.09 8831768
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 3.2 8831768
NPT996 Protein Complex GABA-A receptor; anion channel Homo sapiens IC50 = 127000 nM 10780899
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 12213053
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 490 nM 12213053
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 328 nM 12213053
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1940 nM 12213053
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 296 nM 12213053
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 338 nM 12213053
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 233 nM 12213053
NPT5679 Others Monoamine transporters; serotonin & dopamine Homo sapiens Ratio = 0.7 12213053
NPT5680 Others Monoamine transporters; Norepinephrine & dopamine Homo sapiens Ratio = 4 12213053
NPT2 Others Unspecified Ratio = 0.6 12213053
NPT2 Others Unspecified Ratio = 1 12213053
NPT2 Others Unspecified Ratio = 0.1 12213053
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 760 nM 10649976
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 390 nM 10649976
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1770 nM 10649976
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 190 nM 10649976
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 340 nM 10649976
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 230 nM 10649976
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 419 nM 14592523
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 330 nM 14592523
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 297 nM 14592523
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 325 nM 14592523
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 645 nM 14592523
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 192 nM 14592523
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 10 mg/kg 2565400
NPT5169 Others Monoclonal antibody (mAb) 2E2 Homo sapiens Ki = 3.5 nM 14695827
NPT5169 Others Monoclonal antibody (mAb) 2E2 Homo sapiens Kd = 4.4 nM 14695827
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 11527726
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 11527726
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3520 nM 11527726
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 191 nM 11527726
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 187 nM 12161139
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 388 nM 9083473
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 285 nM 12825932
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 236 nM 12825932
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 9632375
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 390 nM 9632375
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 280 nM 7932572
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 320 nM 7932572
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 14711303
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 14711303
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 14711303
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 1990 nM 14711303
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 45 nM 14711303
NPT32 Organism Mus musculus Mus musculus ED50 = 18.8 mg/kg 14711303
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.64 mg/kg 14711303
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 173 nM 8632426
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 404 nM 8632426
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ratio = 2.3 8632426
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 74.3 nM 15149693
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 293 nM 15149693
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 3302 nM 15149693
NPT95 Individual Protein Muscarinic acetylcholine receptor M1 Rattus norvegicus Ki = 61397 nM 15149693
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 759 nM 10479296
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 387 nM 10479296
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1770 nM 10479296
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 190 nM 10479296
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 336 nM 10479296
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 230 nM 10479296
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 15800 nM 8246225
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 8246225
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 297 nM 11229756
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 538 nM 11229756
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 686 nM 11229756
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 490 nM 11229756
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 696 nM 11229756
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 7562926
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 272 nM 12798324
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 601 nM 12798324
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 830 nM 12798324
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 267 nM 12798324
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 318 nM 12798324
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 385 nM 12798324
NPT246 Individual Protein Dopamine transporter Homo sapiens Ratio = 1 12798324
NPT295 Individual Protein Serotonin transporter Homo sapiens Ratio = 0.53 12798324
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ratio = 0.46 12798324
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 388 nM 8057273
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 123254 nM 8057273
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 7658431
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3298 nM 7658431
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 7658431
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 95.6 nM 8464040
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 270 nM 8464040
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 230 nM 10966747
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 10966747
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 155 nM 10966747
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 108 nM 10966747
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 9397165
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 9397165
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 9397165
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 37 9397165
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 12 9397165
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 12747792
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 12747792
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 12747792
NPT1790 Individual Protein Dopamine transporter Bos taurus IC50 = 139 nM 2362282
NPT875 Organism Bos taurus Bos taurus IC50 = 843 nM 2362282
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 12699762
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 12699762
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 12699762
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 12723940
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 12723940
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 96 nM 12723940
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 12723940
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 2000 nM 12723940
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 21 mg/kg 12723940
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.5 mg/kg 12723940
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 11881989
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 338 nM 11881989
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 405 nM 11881989
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 300 nM 11150168
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 330 nM 11150168
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 500 nM 11150168
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 310 nM 11150168
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 2700 nM 11150168
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 190 nM 11150168
NPT32 Organism Mus musculus Mus musculus ED50 = 7.92 mg/kg 11150168
NPT32 Organism Mus musculus Mus musculus ED50 = 3.61 mg/kg 11150168
NPT246 Individual Protein Dopamine transporter Homo sapiens Ratio = 1.1 11150168
NPT295 Individual Protein Serotonin transporter Homo sapiens Ratio = 0.62 11150168
NPT295 Individual Protein Serotonin transporter Homo sapiens Ratio = 0.07 11150168
NPT5679 Others Monoamine transporters; serotonin & dopamine Homo sapiens Ratio = 0.94 11150168
NPT5680 Others Monoamine transporters; Norepinephrine & dopamine Homo sapiens Ratio = 0.58 11150168
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 249 nM 9258354
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 160 nM 10072685
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 404 nM 10072685
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 301 nM 10698458
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 186 nM 10698458
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 413 nM 10698458
NPT5679 Others Monoamine transporters; serotonin & dopamine Homo sapiens Ratio = 1.4 10698458
NPT5681 Others Serotonin and norepinephrine transporters (SERT/NET) Homo sapiens Ratio = 2.2 10698458
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 107 nM 8098066
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 187 nM 8098066
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 138 nM 8098066
NPT2 Others Unspecified Ratio = 0.77 8098066
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 14505672
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 14505672
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 14505672
NPT2 Others Unspecified Ratio = 0.37 14505672
NPT2 Others Unspecified Ratio = 0.26 14505672
NPT2 Others Unspecified Ratio = 0.7 14505672
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 510.6 nM 11714614
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 10821718
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 10821718
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 10821718
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1740 nM 10821718
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 264 nM 10821718
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 343 nM 10821718
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 301 nM 10821718
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 258 nM 10821718
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 276 nM 10821718
NPT5680 Others Monoamine transporters; Norepinephrine & dopamine Homo sapiens Ratio = 0.2 10821718
NPT5681 Others Serotonin and norepinephrine transporters (SERT/NET) Homo sapiens Ratio = 0.7 10821718
NPT5679 Others Monoamine transporters; serotonin & dopamine Homo sapiens Ratio = 0.37 10821718
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 280 nM 10888328
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 420 nM 10888328
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 160 nM 10888328
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 10888328
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 146 nM 11514143
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 259 nM 11514143
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 11514143
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 11514143
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 10.1016/S0960-894X(97)10053-1
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 10.1016/S0960-894X(97)10053-1
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 10.1016/S0960-894X(97)10053-1
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 259 nM 15163183
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 15163183
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 15163183
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.6 15163183
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 0.42 15163183
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 0.7 15163183
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 1732521
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 11078197
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 1900 nM 11078197
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 11078197
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 11078197
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 95 nM 11078197
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32 nM 7966147
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 388 nM 7966147
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 405 nM 7966147
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 350 nM 8558525
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki > 10000 nM 8558525
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki > 30000 nM 8558525
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 1619622
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3825 nM 1619622
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1059 nM 1619622
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ratio = 38 1619622
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ratio = 10 1619622
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 320 nM 10406650
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 280 nM 10406650
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 11806716
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 11806716
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 11806716
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 160 nM 12672245
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 404 nM 12672245
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 389 nM 12672245
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 67.8 nM 2033595
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 1732520
NPT29 Organism Rattus norvegicus Rattus norvegicus Ki = 320 nM 10.1016/S0960-894X(01)80133-5
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 280 nM 10.1016/S0960-894X(01)80133-5
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 8863789
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3298 nM 8863789
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1045 nM 8863789
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 230 nM 10937724
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 301 nM 10937724
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 186 nM 10937724
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 413 nM 10937724
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 1.4 10937724
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 285 nM 15189035
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 286 nM 15189035
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 3300 nM 15189035
NPT95 Individual Protein Muscarinic acetylcholine receptor M1 Rattus norvegicus Ki = 61400 nM 15189035
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 236 nM 15189035
NPT98 Individual Protein HERG Homo sapiens IC50 = 7244.36 nM 12873512
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 12646032
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 12646032
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 12646032
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 642 nM 8182712
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 603000 nM 8182712
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 259 nM 11909701
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 11909701
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 11909701
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.6 11909701
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio = 0.42 11909701
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 0.7 11909701
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 478 nM 8941383
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 660 nM 8941383
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 341 nM 8941383
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 304 nM 8941383
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 11300876
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 11300876
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 11300876
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 2.7 11300876
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 9934496
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 9934496
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 9934496
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 187 nM 10543888
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 205 nM 10543888
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 172 nM 10543888
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 3300 nM 10543888
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 230 nM 10612593
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 420 nM 10612593
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 160 nM 10612593
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89 nM 9111298
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 9111298
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 9111298
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 460 nM 12127543
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 130 nM 12127543
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 249 nM 9632371
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 2500 nM 9632371
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 615 nM 9632371
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 400 nM 9836615
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 281 nM 9836615
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 459 nM 9836615
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 9836615
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 168 nM 9836615
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 9836615
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 510 nM 8201589
NPT2 Others Unspecified Kd = 1750000 nM 10987420
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 9599245
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 239 nM 9599245
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 11960503
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 11960503
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 11960503
NPT2 Others Unspecified Ratio = 2.7 11960503
NPT2 Others Unspecified Ratio = 0.26 11960503
NPT2 Others Unspecified Ratio = 0.7 11960503
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 70 nM 8035432
NPT29 Organism Rattus norvegicus Rattus norvegicus IC50 = 210 nM 8035432
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 102 nM 1588560
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 32000 nM 15743177
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 388000 nM 15743177
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 405000 nM 15743177
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 1050 nM 15686927
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 89 nM 15686927
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 3320 nM 15686927
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio = 0.08 15686927
NPT5677 Others Monoamine transporters; Norepinephrine & serotonin Rattus norvegicus Ratio = 3.2 15686927
NPT98 Individual Protein HERG Homo sapiens IC50 = 5754.4 nM 15745831
NPT2 Others Unspecified IC50 = 100 nM 15546718
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 266 nM 15456254
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 737 nM 15456254
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3530 nM 15456254
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 423 nM 15537337
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 155 nM 15537337
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 108 nM 15537337
NPT2 Others Unspecified IC50 = 89.1 nM 15828814
NPT2 Others Unspecified Ki = 1050 nM 15828814
NPT2 Others Unspecified Ki = 3300 nM 15828814
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 289 nM 15828826
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 367 nM 15828826
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 462 nM 15828826
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 2990 nM 15828826
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 289 nM 15828826
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 433 nM 15828826
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 150 nM 15857139
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 353.1 nM 15857139
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 0.5 nM 15857139
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus IC50 = 3300 nM 15916437
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 1900 nM 15916437
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 89.1 nM 15916437
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 1050 nM 15916437
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 95 nM 15916437
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 234.42 nM 15808487
NPT98 Individual Protein HERG Homo sapiens IC50 = 7244.36 nM 15911273
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 104 nM 16165350
NPT32 Organism Mus musculus Mus musculus Activity = 16.7 m/3h 16165350
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 74.3 nM 16213721
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 432 nM 16480278
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 461 nM 16480278
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 358 nM 16480278
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 494 nM 16480278
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 2150 nM 16480278
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 378 nM 16480278
NPT32 Organism Mus musculus Mus musculus Activity = 194 s 16821765
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 226 nM 16821765
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus IC50 = 400 nM 16821765
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 900 nM 16821765
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 300 nM 16821765
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 45 nM 16854064
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 1050 nM 16854064
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1990 nM 16854064
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 3300 nM 16854064
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 89.1 nM 16854064
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 71.8 nM 17034144
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus IC50 = 236 nM 17034144
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 286 nM 17034144
NPT3986 Individual Protein Norepinephrine transporter Rattus norvegicus Ki = 3300 nM 17034144
NPT95 Individual Protein Muscarinic acetylcholine receptor M1 Rattus norvegicus Ki = 61400 nM 17034144
NPT4790 Others Monoamine transporters; serotonin & dopamine Rattus norvegicus Ratio Ki = 4 17034144
NPT5676 Others Monoamine transporters; Norepininephrine & dopamine Rattus norvegicus Ratio Ki = 46 17034144
NPT2 Others Unspecified Ratio Ki = 853 17034144
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 500 nM 17228864
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 240 nM 17228864
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 340 nM 17228864
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 250 nM 17228864
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 500 nM 17228864
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 210 nM 17228864
NPT5680 Others Monoamine transporters; Norepinephrine & dopamine Homo sapiens Ratio Ki = 1 17228864
NPT5680 Others Monoamine transporters; Norepinephrine & dopamine Homo sapiens Ratio Ki = 0.88 17228864
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 89.1 nM 15566309
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 3300 nM 15566309
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1990 nM 15566309
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 1050 nM 15566309
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 45 nM 15566309
NPT32 Organism Mus musculus Mus musculus ED50 = 10 mg/kg 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 27 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 14 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = -17 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = -9 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 127 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 24 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 10 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = -21 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 341 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 100 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = -10 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 16 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 269 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 391 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 255 % 15566309
NPT32 Organism Mus musculus Mus musculus Activity = 91 % 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 2.44 mg/kg 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 21 % 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 32 % 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 59 % 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 82 % 15566309
NPT29 Organism Rattus norvegicus Rattus norvegicus Activity = 97 % 15566309
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 89.1 nM 16279803
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 3300 nM 16279803
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1990 nM 16279803
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 1050 nM 16279803
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 45 nM 16279803
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 347 nM 17446076
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 524 nM 17446076
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 111 nM 17399987
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 630 nM 17446076
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 965 nM 17446076
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 887 nM 17446076
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 182 nM 17446076
NPT2 Others Unspecified Activity = 0.58 nM 17698848
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 1060 nM 17255098
NPT2 Others Unspecified IC50 = 507 nM 17255098
NPT2 Others Unspecified IC50 = 1172 nM 17255098
NPT2 Others Unspecified IC50 = 759 nM 17255098
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 392 nM 17255098
NPT2 Others Unspecified IC50 = 283 nM 17255098
NPT2 Others Unspecified IC50 = 366 nM 17255098
NPT2 Others Unspecified IC50 = 259 nM 17255098
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 341 nM 18393401
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 129 nM 18393401
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 478 nM 18393401
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 304 nM 18393401
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 371 nM 19014888
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 276 nM 19014888
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1115 nM 19014888
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 303 nM 19014888
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 416 nM 19014888
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 835 nM 19014888
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 89.1 nM 18434164
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1990 nM 18434164
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 95 nM 18434164
NPT98 Individual Protein HERG Homo sapiens IC50 = 7244.36 nM 18448342
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 130 nM 17846138
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 180 nM 17846138
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 1900 nM 17846138
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 371 nM 19256502
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 276 nM 19256502
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1115 nM 19256502
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 303 nM 19256502
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 416 nM 19256502
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 835 nM 19256502
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 371 nM 19201198
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 276 nM 19201198
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1116 nM 19201198
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 590 nM 19201198
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 642 nM 19201198
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 1281 nM 19201198
NPT98 Individual Protein HERG Homo sapiens IC50 = 5754.4 nM 19110341
NPT2 Others Unspecified Ki = 16218.1 nM 19419864
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ratio Ki = 3 19442525
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 89.1 nM 19523837
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 95 nM 19523837
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1990 nM 19523837
NPT2 Others Unspecified Ratio = 22 19523837
NPT2 Others Unspecified Ratio Ki = 21 19523837
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 830 nM 19821577
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 601 nM 19821577
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 385 nM 19821577
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 318 nM 19821577
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 272 nM 19821577
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 267 nM 19821577
NPT29 Organism Rattus norvegicus Rattus norvegicus ED50 = 5.9 mg/kg 19821577
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 237 nM 19896846
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 286 nM 19896846
NPT1071 Individual Protein Transporter Rattus norvegicus Ki = 3192 nM 19896846
NPT2 Others Unspecified Ratio = 0.83 19896846
NPT2 Others Unspecified Ratio = 12 19896846
NPT2 Others Unspecified Ratio = 11 19896846
NPT32 Organism Mus musculus Mus musculus Activity = 0 min 19821577
NPT32 Organism Mus musculus Mus musculus ED50 = 7.8 mg/kg 19821577
NPT2 Others Unspecified IC50 = 49000 nM 19346132
NPT2 Others Unspecified IC50 = 48977.88 nM 19346132
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 431 nM 19740668
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 525 nM 19740668
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 2377 nM 19740668
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 227 nM 19740668
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 338 nM 19740668
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 232 nM 19740668
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 670 nM 21146984
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 540 nM 21146984
NPT1073 Individual Protein Dopamine transporter Rattus norvegicus Ki = 71.8 nM 21344069
NPT1072 Individual Protein Serotonin transporter Rattus norvegicus Ki = 286 nM 21344069
NPT1071 Individual Protein Transporter Rattus norvegicus Ki = 3300 nM 21344069
NPT295 Individual Protein Serotonin transporter Homo sapiens Ki = 818 nM 23602445
NPT295 Individual Protein Serotonin transporter Homo sapiens IC50 = 2398.83 nM 23602445
NPT228 Individual Protein Norepinephrine transporter Homo sapiens Ki = 1257 nM 23602445
NPT228 Individual Protein Norepinephrine transporter Homo sapiens IC50 = 6309.57 nM 23602445
NPT246 Individual Protein Dopamine transporter Homo sapiens Ki = 249 nM 23602445
NPT246 Individual Protein Dopamine transporter Homo sapiens IC50 = 645.65 nM 23602445
NPT2 Others Unspecified IC50 = 575 nM 448684
NPT32 Organism Mus musculus Mus musculus ED50 = 0 umol/kg 16133
NPT2 Others Unspecified Activity = 130 % 24792462

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC281104 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.8906 High Similarity NPC26285
0.8195 Intermediate Similarity NPC84281
0.8195 Intermediate Similarity NPC291027
0.8195 Intermediate Similarity NPC213126
0.8195 Intermediate Similarity NPC317474
0.8195 Intermediate Similarity NPC169485
0.7914 Intermediate Similarity NPC69496
0.7908 Intermediate Similarity NPC476443
0.7908 Intermediate Similarity NPC133817
0.7826 Intermediate Similarity NPC65310
0.781 Intermediate Similarity NPC285394
0.7746 Intermediate Similarity NPC233910
0.7746 Intermediate Similarity NPC245836
0.7582 Intermediate Similarity NPC68967
0.7566 Intermediate Similarity NPC214239
0.75 Intermediate Similarity NPC474847
0.7407 Intermediate Similarity NPC149691
0.7405 Intermediate Similarity NPC469636
0.7388 Intermediate Similarity NPC307651
0.7349 Intermediate Similarity NPC35680
0.7313 Intermediate Similarity NPC474176
0.7313 Intermediate Similarity NPC128368
0.7287 Intermediate Similarity NPC474365
0.7287 Intermediate Similarity NPC301943
0.7273 Intermediate Similarity NPC83628
0.7273 Intermediate Similarity NPC265407
0.7218 Intermediate Similarity NPC158854
0.7214 Intermediate Similarity NPC50872
0.7205 Intermediate Similarity NPC26353
0.7188 Intermediate Similarity NPC146351
0.7164 Intermediate Similarity NPC474157
0.7152 Intermediate Similarity NPC161827
0.7143 Intermediate Similarity NPC474364
0.7133 Intermediate Similarity NPC319645
0.7124 Intermediate Similarity NPC297322
0.7111 Intermediate Similarity NPC82899
0.7111 Intermediate Similarity NPC270699
0.711 Intermediate Similarity NPC166979
0.7109 Intermediate Similarity NPC78701
0.7109 Intermediate Similarity NPC225060
0.7109 Intermediate Similarity NPC35448
0.7103 Intermediate Similarity NPC103605
0.7103 Intermediate Similarity NPC81092
0.709 Intermediate Similarity NPC196246
0.709 Intermediate Similarity NPC214067
0.708 Intermediate Similarity NPC210092
0.7073 Intermediate Similarity NPC35345
0.7055 Intermediate Similarity NPC52059
0.7055 Intermediate Similarity NPC470069
0.7054 Intermediate Similarity NPC325497
0.7052 Intermediate Similarity NPC162694
0.7045 Intermediate Similarity NPC167336
0.7045 Intermediate Similarity NPC269457
0.7037 Intermediate Similarity NPC210089
0.7037 Intermediate Similarity NPC476750
0.7037 Intermediate Similarity NPC305912
0.7037 Intermediate Similarity NPC1082
0.7034 Intermediate Similarity NPC305717
0.7031 Intermediate Similarity NPC92754
0.7031 Intermediate Similarity NPC276775
0.7031 Intermediate Similarity NPC249912
0.703 Intermediate Similarity NPC474858
0.7021 Intermediate Similarity NPC473243
0.7019 Intermediate Similarity NPC263709
0.7019 Intermediate Similarity NPC310403
0.7019 Intermediate Similarity NPC97380
0.7019 Intermediate Similarity NPC148468
0.7019 Intermediate Similarity NPC243673
0.7019 Intermediate Similarity NPC63210
0.7015 Intermediate Similarity NPC10251
0.7015 Intermediate Similarity NPC17417
0.7011 Intermediate Similarity NPC141440
0.7007 Intermediate Similarity NPC474363
0.7 Intermediate Similarity NPC42211
0.6993 Remote Similarity NPC472703
0.6985 Remote Similarity NPC269340
0.6978 Remote Similarity NPC190298
0.6966 Remote Similarity NPC476599
0.6963 Remote Similarity NPC251854
0.6963 Remote Similarity NPC93084
0.6944 Remote Similarity NPC472704
0.694 Remote Similarity NPC56493
0.6934 Remote Similarity NPC161611
0.6933 Remote Similarity NPC90194
0.6933 Remote Similarity NPC475598
0.6933 Remote Similarity NPC49577
0.6933 Remote Similarity NPC9687
0.6933 Remote Similarity NPC79465
0.6933 Remote Similarity NPC151706
0.6933 Remote Similarity NPC476102
0.6933 Remote Similarity NPC474787
0.6933 Remote Similarity NPC474855
0.6933 Remote Similarity NPC260045
0.6933 Remote Similarity NPC474811
0.6933 Remote Similarity NPC293377
0.6933 Remote Similarity NPC118099
0.6933 Remote Similarity NPC273907
0.6933 Remote Similarity NPC76785
0.6933 Remote Similarity NPC475318
0.6923 Remote Similarity NPC329992
0.6923 Remote Similarity NPC118343
0.6918 Remote Similarity NPC472706
0.6913 Remote Similarity NPC313663
0.6912 Remote Similarity NPC476003
0.6901 Remote Similarity NPC80150
0.6894 Remote Similarity NPC89886
0.6894 Remote Similarity NPC234305
0.6892 Remote Similarity NPC147561
0.6884 Remote Similarity NPC153053
0.6884 Remote Similarity NPC308744
0.6879 Remote Similarity NPC128683
0.6875 Remote Similarity NPC223351
0.6875 Remote Similarity NPC130398
0.6871 Remote Similarity NPC472707
0.6871 Remote Similarity NPC474058
0.6871 Remote Similarity NPC213969
0.6871 Remote Similarity NPC165726
0.687 Remote Similarity NPC70624
0.6866 Remote Similarity NPC37622
0.6866 Remote Similarity NPC119271
0.6866 Remote Similarity NPC30594
0.686 Remote Similarity NPC27887
0.6852 Remote Similarity NPC153694
0.6852 Remote Similarity NPC211525
0.6845 Remote Similarity NPC293255
0.6845 Remote Similarity NPC21752
0.6845 Remote Similarity NPC298851
0.6845 Remote Similarity NPC476425
0.6845 Remote Similarity NPC210415
0.6845 Remote Similarity NPC181138
0.6845 Remote Similarity NPC276993
0.6838 Remote Similarity NPC292758
0.6838 Remote Similarity NPC174099
0.6838 Remote Similarity NPC65855
0.6833 Remote Similarity NPC70290
0.6833 Remote Similarity NPC14622
0.6833 Remote Similarity NPC124302
0.6833 Remote Similarity NPC73020
0.6833 Remote Similarity NPC46744
0.6833 Remote Similarity NPC215098
0.6826 Remote Similarity NPC476749
0.6821 Remote Similarity NPC153617
0.6818 Remote Similarity NPC183270
0.6818 Remote Similarity NPC477904
0.6816 Remote Similarity NPC33256
0.6812 Remote Similarity NPC272524
0.6809 Remote Similarity NPC469574
0.6806 Remote Similarity NPC160493
0.6802 Remote Similarity NPC309692
0.6798 Remote Similarity NPC166521
0.6798 Remote Similarity NPC94499
0.6798 Remote Similarity NPC172769
0.6798 Remote Similarity NPC184195
0.6798 Remote Similarity NPC205
0.6798 Remote Similarity NPC124690
0.6798 Remote Similarity NPC281470
0.6797 Remote Similarity NPC216149
0.6797 Remote Similarity NPC208170
0.6794 Remote Similarity NPC203925
0.6792 Remote Similarity NPC162104
0.6791 Remote Similarity NPC209632
0.6788 Remote Similarity NPC167504
0.678 Remote Similarity NPC40539
0.6779 Remote Similarity NPC475508
0.6776 Remote Similarity NPC119818
0.6776 Remote Similarity NPC2173
0.6776 Remote Similarity NPC328700
0.6776 Remote Similarity NPC202771
0.6772 Remote Similarity NPC476444
0.6765 Remote Similarity NPC40178
0.6759 Remote Similarity NPC474283
0.6759 Remote Similarity NPC475692
0.6758 Remote Similarity NPC226652
0.6758 Remote Similarity NPC72788
0.6758 Remote Similarity NPC314100
0.6758 Remote Similarity NPC120671
0.6742 Remote Similarity NPC108276
0.6742 Remote Similarity NPC163578
0.6742 Remote Similarity NPC226708
0.6739 Remote Similarity NPC321852
0.6739 Remote Similarity NPC474314
0.6739 Remote Similarity NPC158282
0.6739 Remote Similarity NPC79496
0.6735 Remote Similarity NPC476033
0.6735 Remote Similarity NPC275576
0.6733 Remote Similarity NPC470278
0.6724 Remote Similarity NPC473562
0.6722 Remote Similarity NPC477258
0.6716 Remote Similarity NPC31786
0.6716 Remote Similarity NPC114594
0.6715 Remote Similarity NPC24777
0.6714 Remote Similarity NPC474095
0.6714 Remote Similarity NPC474685
0.6712 Remote Similarity NPC475691
0.6711 Remote Similarity NPC134937
0.6711 Remote Similarity NPC473359
0.6711 Remote Similarity NPC298547
0.6711 Remote Similarity NPC474608
0.6711 Remote Similarity NPC324898
0.6709 Remote Similarity NPC473541

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC281104 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
1.0 High Similarity NPD2567 Approved
1.0 High Similarity NPD2569 Approved
0.8195 Intermediate Similarity NPD2611 Approved
0.8195 Intermediate Similarity NPD3132 Approved
0.8195 Intermediate Similarity NPD2608 Approved
0.8195 Intermediate Similarity NPD4218 Approved
0.8195 Intermediate Similarity NPD2612 Approved
0.8195 Intermediate Similarity NPD4215 Approved
0.8195 Intermediate Similarity NPD3131 Approved
0.8195 Intermediate Similarity NPD4217 Approved
0.8195 Intermediate Similarity NPD4216 Approved
0.8195 Intermediate Similarity NPD2609 Approved
0.8195 Intermediate Similarity NPD2610 Approved
0.7958 Intermediate Similarity NPD1654 Clinical (unspecified phase)
0.7955 Intermediate Similarity NPD2115 Approved
0.7955 Intermediate Similarity NPD2117 Pre-registration
0.7955 Intermediate Similarity NPD2116 Approved
0.7914 Intermediate Similarity NPD2613 Approved
0.7895 Intermediate Similarity NPD2994 Approved
0.7883 Intermediate Similarity NPD2199 Approved
0.7883 Intermediate Similarity NPD2198 Approved
0.7857 Intermediate Similarity NPD6039 Approved
0.7836 Intermediate Similarity NPD3032 Approved
0.7836 Intermediate Similarity NPD3031 Approved
0.7836 Intermediate Similarity NPD3030 Approved
0.7826 Intermediate Similarity NPD2625 Approved
0.7826 Intermediate Similarity NPD2626 Approved
0.7826 Intermediate Similarity NPD2159 Approved
0.7826 Intermediate Similarity NPD2160 Approved
0.7826 Intermediate Similarity NPD2628 Approved
0.7826 Intermediate Similarity NPD2627 Approved
0.781 Intermediate Similarity NPD5159 Phase 2
0.781 Intermediate Similarity NPD5158 Clinical (unspecified phase)
0.781 Intermediate Similarity NPD5157 Phase 1
0.7754 Intermediate Similarity NPD5667 Approved
0.7746 Intermediate Similarity NPD3615 Approved
0.7746 Intermediate Similarity NPD4746 Phase 3
0.7746 Intermediate Similarity NPD3614 Approved
0.7746 Intermediate Similarity NPD3088 Approved
0.7746 Intermediate Similarity NPD2572 Clinical (unspecified phase)
0.7746 Intermediate Similarity NPD3616 Approved
0.7746 Intermediate Similarity NPD2573 Approved
0.7746 Intermediate Similarity NPD3089 Approved
0.7746 Intermediate Similarity NPD2570 Approved
0.7746 Intermediate Similarity NPD2574 Discontinued
0.7746 Intermediate Similarity NPD3087 Approved
0.7746 Intermediate Similarity NPD4745 Approved
0.7746 Intermediate Similarity NPD3090 Approved
0.7746 Intermediate Similarity NPD2566 Approved
0.7746 Intermediate Similarity NPD2571 Approved
0.774 Intermediate Similarity NPD7702 Clinical (unspecified phase)
0.7721 Intermediate Similarity NPD2946 Phase 2
0.7692 Intermediate Similarity NPD2201 Approved
0.7639 Intermediate Similarity NPD4685 Phase 3
0.7639 Intermediate Similarity NPD4684 Phase 3
0.7639 Intermediate Similarity NPD4686 Approved
0.7634 Intermediate Similarity NPD4573 Approved
0.7634 Intermediate Similarity NPD4571 Approved
0.7634 Intermediate Similarity NPD4572 Approved
0.7622 Intermediate Similarity NPD7713 Phase 3
0.7584 Intermediate Similarity NPD2575 Approved
0.7483 Intermediate Similarity NPD3170 Approved
0.7466 Intermediate Similarity NPD3528 Clinical (unspecified phase)
0.7448 Intermediate Similarity NPD6311 Approved
0.7448 Intermediate Similarity NPD6309 Approved
0.7448 Intermediate Similarity NPD6310 Approved
0.7448 Intermediate Similarity NPD3373 Approved
0.7431 Intermediate Similarity NPD4621 Approved
0.7431 Intermediate Similarity NPD4619 Approved
0.7424 Intermediate Similarity NPD2181 Clinical (unspecified phase)
0.7415 Intermediate Similarity NPD2670 Approved
0.7353 Intermediate Similarity NPD4576 Approved
0.7353 Intermediate Similarity NPD4574 Approved
0.7348 Intermediate Similarity NPD5240 Approved
0.7348 Intermediate Similarity NPD5237 Approved
0.7348 Intermediate Similarity NPD5239 Approved
0.7348 Intermediate Similarity NPD5236 Approved
0.7348 Intermediate Similarity NPD5235 Approved
0.7329 Intermediate Similarity NPD3140 Approved
0.7329 Intermediate Similarity NPD3142 Approved
0.7325 Intermediate Similarity NPD4424 Discontinued
0.7313 Intermediate Similarity NPD2607 Approved
0.7308 Intermediate Similarity NPD6591 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD7611 Approved
0.7259 Intermediate Similarity NPD1374 Approved
0.7259 Intermediate Similarity NPD1371 Approved
0.7259 Intermediate Similarity NPD1373 Approved
0.7259 Intermediate Similarity NPD1370 Approved
0.7252 Intermediate Similarity NPD3524 Approved
0.7252 Intermediate Similarity NPD3526 Approved
0.7237 Intermediate Similarity NPD7488 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD3662 Phase 3
0.7222 Intermediate Similarity NPD5204 Approved
0.7222 Intermediate Similarity NPD3661 Approved
0.7222 Intermediate Similarity NPD3664 Approved
0.7222 Intermediate Similarity NPD3663 Approved
0.7218 Intermediate Similarity NPD1752 Approved
0.7218 Intermediate Similarity NPD1756 Approved
0.7215 Intermediate Similarity NPD5889 Approved
0.7215 Intermediate Similarity NPD5890 Approved
0.7172 Intermediate Similarity NPD5202 Clinical (unspecified phase)
0.7161 Intermediate Similarity NPD8389 Clinical (unspecified phase)
0.7133 Intermediate Similarity NPD1110 Approved
0.7133 Intermediate Similarity NPD1109 Approved
0.7121 Intermediate Similarity NPD810 Approved
0.7121 Intermediate Similarity NPD811 Approved
0.7121 Intermediate Similarity NPD812 Approved
0.7055 Intermediate Similarity NPD4620 Approved
0.7055 Intermediate Similarity NPD4617 Approved
0.7055 Intermediate Similarity NPD5203 Approved
0.7055 Intermediate Similarity NPD5201 Approved
0.7051 Intermediate Similarity NPD7528 Approved
0.7044 Intermediate Similarity NPD6585 Discontinued
0.7042 Intermediate Similarity NPD5338 Clinical (unspecified phase)
0.7015 Intermediate Similarity NPD2182 Approved
0.7007 Intermediate Similarity NPD2652 Approved
0.7007 Intermediate Similarity NPD2650 Approved
0.6987 Remote Similarity NPD1801 Approved
0.6987 Remote Similarity NPD1802 Approved
0.698 Remote Similarity NPD5119 Approved
0.698 Remote Similarity NPD5120 Approved
0.698 Remote Similarity NPD5121 Approved
0.6962 Remote Similarity NPD1670 Discontinued
0.6957 Remote Similarity NPD1711 Phase 2
0.6947 Remote Similarity NPD2196 Discontinued
0.6947 Remote Similarity NPD2193 Phase 2
0.6947 Remote Similarity NPD2648 Phase 3
0.6923 Remote Similarity NPD3050 Clinical (unspecified phase)
0.6923 Remote Similarity NPD5312 Approved
0.6923 Remote Similarity NPD518 Clinical (unspecified phase)
0.6923 Remote Similarity NPD5313 Approved
0.6923 Remote Similarity NPD6287 Discontinued
0.6923 Remote Similarity NPD1238 Approved
0.6913 Remote Similarity NPD7715 Approved
0.6913 Remote Similarity NPD7714 Approved
0.6901 Remote Similarity NPD5306 Approved
0.6901 Remote Similarity NPD5305 Approved
0.6899 Remote Similarity NPD7613 Discontinued
0.6866 Remote Similarity NPD5705 Approved
0.6866 Remote Similarity NPD5706 Approved
0.6866 Remote Similarity NPD5704 Approved
0.6857 Remote Similarity NPD5292 Approved
0.6857 Remote Similarity NPD5291 Approved
0.6852 Remote Similarity NPD6844 Discontinued
0.6849 Remote Similarity NPD552 Approved
0.6849 Remote Similarity NPD553 Approved
0.6849 Remote Similarity NPD9567 Approved
0.6842 Remote Similarity NPD5689 Approved
0.6842 Remote Similarity NPD5688 Approved
0.6839 Remote Similarity NPD2654 Approved
0.6839 Remote Similarity NPD7179 Phase 2
0.6838 Remote Similarity NPD3646 Clinical (unspecified phase)
0.6835 Remote Similarity NPD4766 Approved
0.6833 Remote Similarity NPD4420 Approved
0.6806 Remote Similarity NPD4807 Approved
0.6806 Remote Similarity NPD4806 Approved
0.6803 Remote Similarity NPD4980 Approved
0.68 Remote Similarity NPD7634 Clinical (unspecified phase)
0.68 Remote Similarity NPD520 Approved
0.6797 Remote Similarity NPD3648 Clinical (unspecified phase)
0.6791 Remote Similarity NPD2192 Approved
0.6791 Remote Similarity NPD2197 Approved
0.679 Remote Similarity NPD6386 Approved
0.679 Remote Similarity NPD6385 Approved
0.6783 Remote Similarity NPD4593 Approved
0.6783 Remote Similarity NPD4594 Approved
0.6779 Remote Similarity NPD5454 Clinical (unspecified phase)
0.6776 Remote Similarity NPD6817 Clinical (unspecified phase)
0.6776 Remote Similarity NPD6073 Approved
0.6776 Remote Similarity NPD5006 Approved
0.6776 Remote Similarity NPD5005 Approved
0.677 Remote Similarity NPD2512 Phase 3
0.6768 Remote Similarity NPD5616 Clinical (unspecified phase)
0.6748 Remote Similarity NPD3589 Clinical (unspecified phase)
0.6736 Remote Similarity NPD4136 Approved
0.6736 Remote Similarity NPD4106 Approved
0.6736 Remote Similarity NPD4135 Approved
0.6731 Remote Similarity NPD6860 Clinical (unspecified phase)
0.6727 Remote Similarity NPD5019 Clinical (unspecified phase)
0.6716 Remote Similarity NPD2577 Clinical (unspecified phase)
0.6716 Remote Similarity NPD164 Approved
0.6715 Remote Similarity NPD4233 Approved
0.6715 Remote Similarity NPD550 Approved
0.6715 Remote Similarity NPD551 Approved
0.6715 Remote Similarity NPD4234 Approved
0.6711 Remote Similarity NPD4618 Approved
0.6711 Remote Similarity NPD4622 Approved
0.6692 Remote Similarity NPD4188 Approved
0.6692 Remote Similarity NPD4189 Approved
0.6692 Remote Similarity NPD2171 Approved
0.669 Remote Similarity NPD7436 Approved
0.669 Remote Similarity NPD7437 Approved
0.6689 Remote Similarity NPD7086 Phase 2
0.6687 Remote Similarity NPD8005 Clinical (unspecified phase)
0.6667 Remote Similarity NPD8173 Phase 2
0.6667 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6667 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6667 Remote Similarity NPD1677 Discontinued
0.6667 Remote Similarity NPD5725 Approved
0.6667 Remote Similarity NPD8172 Phase 2

Structure

External Identifiers

PubChem CID   446220
ChEMBL   CHEMBL370805
ZINC  

Physicochemical Properties

Molecular Weight:  303.15
ALogP:  -1.1243
MLogP:  2.78
XLogP:  3.336
# Rotatable Bonds:  7
Polar Surface Area:  55.84
# H-Bond Aceptor:  5
# H-Bond Donor:  0
# Rings:  3
# Heavy Atoms:  22

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs