Natural Product: NPC257728

Natural Product ID:  NPC257728
Common Name:   Novobiocin
IUPAC Name:   [(3R,4S,5R,6R)-5-hydroxy-6-[4-hydroxy-3-[[4-hydroxy-3-(3-methylbut-2-enyl)benzoyl]amino]-8-methyl-2-oxochromen-7-yl]oxy-3-methoxy-2,2-dimethyloxan-4-yl] carbamate
Synonyms:   Albamycin; Albamycin T; Cathomycin; Novobiocin
Molecular Formula:   C31H36N2O11
Standard InCHIKey:  YJQPYGGHQPGBLI-KGSXXDOSSA-N
Standard InCHI:  InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1
Canonical SMILES:  CO[C@@H]1[C@@H](OC(=N)O)[C@@H](O)[C@@H](OC1(C)C)Oc1ccc2c(c1C)oc(=O)c(c2O)NC(=O)c1ccc(c(c1)CC=C(C)C)O
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   BGC0000834 ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO23850 Actinoalloteichus cyanogriseus Species Pseudonocardiaceae Bacteria StreptomeDB*
NPO32951 streptomyces sp. ifm 10937 Species Streptomycetaceae Bacteria PMID[18847278]
NPO33384 Nocardiopsis gilva YIM 90087 Species Nocardiopsaceae Bacteria PMID[23441911]
NPO33524 Streptomyces spheroides Species Streptomycetaceae Bacteria PMID[21486005]
NPO6655 Streptomyces niveus Species Streptomycetaceae Bacteria PMID[19762445]
NPO730 Escherichia coli Species Enterobacteriaceae Bacteria PMID[21988831]
NPO6511 Strychni semen NA NA NA TCMSP*
NPO4775.2 Streptomyces spheroides ncib 11891 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO31697 Streptomyces ifm 10937 Species Streptomycetaceae Bacteria StreptomeDB*
NPO10330.25 Streptomyces coelicolor m512 nov-bg1 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO32022 Streptomyces rja2961 Species Streptomycetaceae Bacteria StreptomeDB*
NPO10330.24 Streptomyces coelicolor m512 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO6655.2 Streptomyces niveus nrrl 2466 Subspecies Streptomycetaceae Bacteria StreptomeDB*
NPO31751 Streptomyces l-4-4 Species Streptomycetaceae Bacteria StreptomeDB*
NPO22810 Streptomyces Species Streptomycetaceae Bacteria StreptomeDB*
NPO6655 Streptomyces niveus Species Streptomycetaceae Bacteria StreptomeDB*
NPO4775.3 Streptomyces spheroides ncimb 11891 Subspecies Streptomycetaceae Bacteria StreptomeDB*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 0.25 ug/ml 15125947
NPT317 Uncleic Acid Nucleic Acid IC50 = 25 ug/ml 15125947
NPT320 Protein Family DNA topoisomerase II Homo sapiens IC50 > 400 ug/ml 15125947
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 15125947
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 2 ug/ml 15125947
NPT2 Others Unspecified Ratio = 1 10673102
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 10673102
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 10 ug/ml 10673102
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC < 0.04 ug/ml 10673102
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 0.3 ug/ml 10673102
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 0.6 ug/ml 10673102
NPT322 Individual Protein DNA topoisomerase II beta Homo sapiens Ratio = 1 10522710
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 10522710
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 20 ug/ml 10522710
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.08 ug/ml 10522710
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.15 ug/ml 10522710
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 0.3 ug/ml 10522710
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 0.25 ug/ml 11378377
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 11378377
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 2.5 ug/ml 11378377
NPT19 Organism Escherichia coli Escherichia coli MIC > 64 ug/ml 14998336
NPT1521 Organism Stenotrophomonas maltophilia Stenotrophomonas maltophilia MIC > 64 ug/ml 14998336
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 14998336
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.12 ug/ml 14998336
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.25 ug/ml 14998336
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 4 ug/ml 14998336
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1 ug/ml 14998336
NPT16 Organism Staphylococcus aureus Staphylococcus aureus ED50 = 3 mg/kg 14998336
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC50 = 4 ug/ml 14998336
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC90 = 8 ug/ml 14998336
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 Ratio = 1 10450985
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 10450985
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 20 ug/ml 10450985
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.08 ug/ml 10450985
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 0.15 ug/ml 10450985
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 0.3 ug/ml 10450985
NPT4940 Individual Protein DNA gyrase subunit B Escherichia coli K-12 Ratio = 1 10522711
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 10522711
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 20 ug/ml 10522711
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.08 ug/ml 10522711
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.15 ug/ml 10522711
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 0.3 ug/ml 10522711
NPT2 Others Unspecified Ratio = 1 10937727
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 0.04 ug/ml 10937727
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 10 ug/ml 10937727
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC < 0.04 ug/ml 10937727
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 0.3 ug/ml 10937727
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 0.6 ug/ml 10937727
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 15214796
NPT19 Organism Escherichia coli Escherichia coli MIC = 64 ug/ml 15214796
NPT19 Organism Escherichia coli Escherichia coli MIC = 0.5 ug/ml 15214796
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 15214796
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 4 ug/ml 15214796
NPT2 Others Unspecified MIC = 0.5 ug/ml 15214796
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 2 ug/ml 15214796
NPT317 Uncleic Acid Nucleic Acid IC50 = 0.25 ug/ml 15214796
NPT317 Uncleic Acid Nucleic Acid IC50 = 28 ug/ml 15214796
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 0.25 ug/ml 15214796
NPT317 Uncleic Acid Nucleic Acid IC50 = 3.5 ug/ml 15214796
NPT317 Uncleic Acid Nucleic Acid IC50 > 400 ug/ml 15214796
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 10782694
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 8 ug/ml 10782694
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 16 ug/ml 10782694
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.12 ug/ml 10782694
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 2 ug/ml 10782694
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 8 ug/ml 10782694
NPT19 Organism Escherichia coli Escherichia coli MIC = 125 ug/ml 10956216
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae MIC = 250 ug/ml 10956216
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae MIC = 62 ug/ml 10956216
NPT2 Others Unspecified Inhibition = 80 % 15582408
NPT2 Others Unspecified Inhibition = 20 % 15582408
NPT2 Others Unspecified Inhibition = 10 % 15582408
NPT19 Organism Escherichia coli Escherichia coli IZ = 9 mm 17149863
NPT19 Organism Escherichia coli Escherichia coli IZ = 15 mm 17149863
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.13 ug/ml 17116675
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 17116675
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1 ug/ml 17116675
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 8 ug/ml 17116675
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 2 ug/ml 17116675
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 0.5 ug/ml 17116675
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 8 ug/ml 17116675
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 4 ug/ml 17116675
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 8 ug/ml 17116675
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 16 ug/ml 17116675
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 32 ug/ml 17116675
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 0.064 ug/ml 17116675
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 8 ug/ml 17116675
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 4 ug/ml 17116675
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 0.25 ug/ml 17116675
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.5 ug/ml 17116675
NPT19 Organism Escherichia coli Escherichia coli MIC = 512 ug/ml 17210767
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 17210767
NPT83 Cell Line MCF7 Homo sapiens IC50 = 260000 nM 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 5.9 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 59.9 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 19.7 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 19.3 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 9.8 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 58.3 % 17979263
NPT83 Cell Line MCF7 Homo sapiens Activity = 21.3 % 17979263
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 0.125 ug/ml 17561394
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.5 ug/ml 17561394
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1 ug/ml 17561394
NPT2 Others Unspecified Activity = 0.25 ug/ml 17632001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 17632001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 8 ug/ml 17632001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.12 ug/ml 17632001
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.12 ug/ml 17632001
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 2 ug/ml 17632001
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC = 8 ug/ml 17632001
NPT2 Others Unspecified IC50 = 500000 nM 18020309
NPT19 Organism Escherichia coli Escherichia coli MIC > 1024 ug/ml 17438056
NPT19 Organism Escherichia coli Escherichia coli MIC = 512 ug/ml 17438056
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium MIC > 1024 ug/ml 17438056
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 0.78 ug/ml 18262793
NPT19 Organism Escherichia coli Escherichia coli MIC = 3.125 ug/ml 18262793
NPT1209 Organism Pseudomonas fluorescens Pseudomonas fluorescens MIC = 1.562 ug/ml 18262793
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 3.125 ug/ml 18262793
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 0.28 ug/ml 18262793
NPT2 Others Unspecified IC50 = 0.31 ug/ml 18262793
NPT1422 Individual Protein ATP-binding cassette sub-family G member 2 Homo sapiens IC50 = 66069.34 nM 18678495
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus Ki = 10 nM 18690678
NPT2 Others Unspecified Ki = 14 nM 18690678
NPT2 Others Unspecified Ki = 110 nM 18690678
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 18690678
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 16 ug/ml 18690678
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 2 ug/ml 18690678
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 0.063 ug/ml 18690678
NPT2 Others Unspecified IC50 = 30 nM 19095445
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 19095445
NPT2 Others Unspecified IC50 = 1320 nM 19095445
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 8 ug/ml 19095445
NPT19 Organism Escherichia coli Escherichia coli MIC = 8 ug/ml 19095445
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 0.78 ug/ml 19147367
NPT19 Organism Escherichia coli Escherichia coli MIC = 3.125 ug/ml 19147367
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 1.562 ug/ml 19147367
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 3.125 ug/ml 19147367
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 0.25 ug/ml 19147367
NPT2 Others Unspecified IC50 = 0.5 ug/ml 19147367
NPT19 Organism Escherichia coli Escherichia coli Activity = 2 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 28.6 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 36.5 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 17 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 25.3 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 36 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 25.5 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 32.6 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 25.7 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 9.5 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 20 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 24.5 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 21.3 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 38.4 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 50.9 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 28.4 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 45.3 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 55.2 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 48.5 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 39.8 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 46.8 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 23.6 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 21.2 % 17606680
NPT19 Organism Escherichia coli Escherichia coli Activity = 26.9 % 17606680
NPT1033 Organism Enterobacter cloacae Enterobacter cloacae IZ = 0 mm 17638702
NPT1033 Organism Enterobacter cloacae Enterobacter cloacae IZ = 14 mm 17638702
NPT1033 Organism Enterobacter cloacae Enterobacter cloacae IZ = 16 mm 17638702
NPT1033 Organism Enterobacter cloacae Enterobacter cloacae IZ = 20 mm 17638702
NPT1033 Organism Enterobacter cloacae Enterobacter cloacae IZ = 22 mm 17638702
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 17502406
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 17502406
NPT519 Cell Line SH-SY5Y Homo sapiens EC50 = 48.39 nM 19138859
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 17876001
NPT1863 Organism Staphylococcus saprophyticus Staphylococcus saprophyticus MIC = 16 ug/ml 17876001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 8 ug/ml 17876001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1 ug/ml 17876001
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 2 ug/ml 17876001
NPT2 Others Unspecified Ratio = 64 17876001
NPT2 Others Unspecified IC50 < 1000 nM 19477652
NPT5485 Organism Mycobacterium leprae Mycobacterium leprae IC50 = 0.25 ug/ml 18070975
NPT5485 Organism Mycobacterium leprae Mycobacterium leprae IC50 = 0.3 ug/ml 18070975
NPT5485 Organism Mycobacterium leprae Mycobacterium leprae IC50 = 0.2 ug/ml 18070975
NPT196 Cell Line AGS Homo sapiens Activity = 63 % 18847278
NPT196 Cell Line AGS Homo sapiens Activity = 72 % 18847278
NPT2 Others Unspecified EC50 = 100000 nM 20014866
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 19683922
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 8 ug/ml 19683922
NPT2 Others Unspecified MIC = 4 ug/ml 19683922
NPT5486 Individual Protein DNA gyrase subunit B Streptococcus pneumoniae serotype 4 (strain ATCC BAA-334 / TIGR4) IC50 = 37 nM 19683922
NPT5487 Individual Protein ParE Streptococcus pneumoniae IC50 = 2030 nM 19683922
NPT16 Organism Staphylococcus aureus Staphylococcus aureus IC50 = 125 nM 19683922
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 4000 ug/ml 19683922
NPT1422 Individual Protein ATP-binding cassette sub-family G member 2 Homo sapiens IC50 = 85100 nM 19932960
NPT1422 Individual Protein ATP-binding cassette sub-family G member 2 Homo sapiens IC50 = 104000 nM 19932960
NPT2 Others Unspecified IC50 = 3 nM 20045642
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 700000 nM 19932969
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 128 ug/ml 20138759
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 20188576
NPT447 Organism Streptomyces Streptomyces IZ = 20 mm 20384319
NPT447 Organism Streptomyces Streptomyces IZ = 18 mm 20384319
NPT447 Organism Streptomyces Streptomyces IZ = 15 mm 20384319
NPT83 Cell Line MCF7 Homo sapiens IC50 = 481300 nM 20570149
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 474700 nM 20570149
NPT19 Organism Escherichia coli Escherichia coli MIC = 500 ug/ml 19884363
NPT19 Organism Escherichia coli Escherichia coli MIC = 40 ug/ml 19884363
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 20655215
NPT2 Others Unspecified MIC = 0.125 ug/ml 20655215
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 20655215
NPT2 Others Unspecified IC50 = 50 nM 20655215
NPT1548 Organism Pseudomonas aeruginosa PAO1 Pseudomonas aeruginosa PAO1 MIC = 16 ug/ml 20655215
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 8 ug/ml 20655215
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 20038628
NPT19 Organism Escherichia coli Escherichia coli MIC = 8 ug/ml 20038628
NPT19 Organism Escherichia coli Escherichia coli MIC = 512 ug/ml 20038628
NPT2 Others Unspecified IC50 = 800 nM 18268084
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 100 nM 18268084
NPT2 Others Unspecified IC50 = 100 nM 18268084
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 20211889
NPT19 Organism Escherichia coli Escherichia coli MIC = 16 ug/ml 20211889
NPT19 Organism Escherichia coli Escherichia coli MIC = 2 ug/ml 20211889
NPT19 Organism Escherichia coli Escherichia coli MIC = 8 ug/ml 20211889
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 800 ug/ml 18676884
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 200 ug/ml 18676884
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC > 1200 ug/ml 18676884
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 12.5 ug/ml 18676884
NPT312 Organism Saccharomyces cerevisiae Saccharomyces cerevisiae IZ = 0 mm 20739103
NPT2 Others Unspecified MIC = 512 ug/ml 18694955
NPT2 Others Unspecified MIC = 256 ug/ml 18694955
NPT2 Others Unspecified MIC = 64 ug/ml 18694955
NPT2 Others Unspecified MIC = 1024 ug/ml 18694955
NPT746 Organism Pasteurella multocida Pasteurella multocida MIC = 40 ug/ml 18725450
NPT746 Organism Pasteurella multocida Pasteurella multocida MIC = 2.5 ug/ml 18725450
NPT746 Organism Pasteurella multocida Pasteurella multocida Ratio = 16 18725450
NPT746 Organism Pasteurella multocida Pasteurella multocida MIC = 20 ug/ml 18725450
NPT746 Organism Pasteurella multocida Pasteurella multocida Ratio = 2 18725450
NPT602 Organism Mycobacterium smegmatis Mycobacterium smegmatis MIC = 4 ug/ml 18458127
NPT602 Organism Mycobacterium smegmatis Mycobacterium smegmatis MIC = 8 ug/ml 18458127
NPT602 Organism Mycobacterium smegmatis Mycobacterium smegmatis Ratio = 2 18458127
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 1600 ug/ml 18285485
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 140 ug/ml 18285485
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa FC = 100000000 18285485
NPT19 Organism Escherichia coli Escherichia coli MIC > 32 ug/ml 18347114
NPT1531 Organism Enterococcus faecium Enterococcus faecium MIC > 32 ug/ml 18347114
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC > 32 ug/ml 18347114
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 2 ug/ml 18347114
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 1 ug/ml 18347114
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC > 32 ug/ml 18347114
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 18347114
NPT4941 Individual Protein Cell division inhibitor sulA Escherichia coli K-12 Activity = 6.3 nM 18347114
NPT4942 Individual Protein DNA gyrase subunit A Escherichia coli K-12 Activity = 3.1 nM 18347114
NPT4940 Individual Protein DNA gyrase subunit B Escherichia coli K-12 Ratio IC50 = 0.8 18347114
NPT4940 Individual Protein DNA gyrase subunit B Escherichia coli K-12 IC50 = 200 nM 18347114
NPT4940 Individual Protein DNA gyrase subunit B Escherichia coli K-12 IC50 = 154 nM 18347114
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 18347114
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae MIC > 32 ug/ml 18347114
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC > 32 ug/ml 18347114
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 1 ug/ml 18347114
NPT1101 Organism Staphylococcus aureus subsp. aureus RN4220 Staphylococcus aureus subsp. aureus RN4220 MIC = 0.125 ug/ml 18519725
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.00125 ug/ml 18519725
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.625 ug/ml 18519725
NPT2 Others Unspecified IC50 = 100 nM 18519725
NPT2 Others Unspecified IC50 = 1000 nM 18519725
NPT173 Organism Klebsiella pneumoniae Klebsiella pneumoniae IZ = 9 mm 19015361
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.049 ug/ml 19164148
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 1024 ug/ml 19164148
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 256 ug/ml 19164148
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 2 ug/ml 19164148
NPT604 Individual Protein Serum albumin Homo sapiens Kd = 12000 nM 19164148
NPT604 Individual Protein Serum albumin Homo sapiens Ratio = 0.5 19164148
NPT604 Individual Protein Serum albumin Homo sapiens Ratio = 1 19164148
NPT604 Individual Protein Serum albumin Homo sapiens Ratio = 1.5 19164148
NPT604 Individual Protein Serum albumin Homo sapiens Ratio = 2 19164148
NPT1548 Organism Pseudomonas aeruginosa PAO1 Pseudomonas aeruginosa PAO1 MIC = 512 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 512 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 64 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 4 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 16 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 32 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa MIC = 8 ug/ml 19258280
NPT1548 Organism Pseudomonas aeruginosa PAO1 Pseudomonas aeruginosa PAO1 MIC = 32 ug/ml 19258280
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa FC = 16 19258280
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium MIC = 256 ug/ml 19470505
NPT566 Organism Salmonella typhimurium Salmonella enterica subsp. enterica serovar Typhimurium MIC = 128 ug/ml 19470505
NPT88 Organism Mycobacterium tuberculosis Mycobacterium tuberculosis FC >= 2 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 16 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 2 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 4 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 1 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 8 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG MIC = 0.5 ug/ml 19564371
NPT1108 Organism Mycobacterium bovis BCG Mycobacterium bovis BCG Ratio = 4 19564371
NPT858 Cell Line LNCaP Homo sapiens IC50 = 420000 nM 21129982
NPT2 Others Unspecified IC50 = 1050 nM 21129982
NPT19 Organism Escherichia coli Escherichia coli MIC = 3.125 ug/ml 18591276
NPT19 Organism Escherichia coli Escherichia coli MIC = 1.56 ug/ml 18591276
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 19770280
NPT19 Organism Escherichia coli Escherichia coli MIC < 0.5 ug/ml 19770280
NPT19 Organism Escherichia coli Escherichia coli MIC = 20 ug/ml 19770280
NPT19 Organism Escherichia coli Escherichia coli Ratio = 5 19770280
NPT747 Organism Acinetobacter baumannii Acinetobacter baumannii MIC = 120 ug/ml 19770280
NPT747 Organism Acinetobacter baumannii Acinetobacter baumannii MIC = 40 ug/ml 19770280
NPT747 Organism Acinetobacter baumannii Acinetobacter baumannii Ratio = 3 19770280
NPT747 Organism Acinetobacter baumannii Acinetobacter baumannii MIC = 84 ug/ml 19770280
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 Ratio = 4 18936189
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 512 ug/ml 18936189
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 4 ug/ml 18936189
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 1024 ug/ml 18936189
NPT19 Organism Escherichia coli Escherichia coli MIC = 32 ug/ml 20876376
NPT19 Organism Escherichia coli Escherichia coli MIC = 1 ug/ml 20876376
NPT19 Organism Escherichia coli Escherichia coli MIC = 64 ug/ml 20876376
NPT19 Organism Escherichia coli Escherichia coli MIC = 256 ug/ml 20876376
NPT5 Individual Protein Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 Homo sapiens Potency 19952.6 nM PubChem BioAssay data set
NPT19 Organism Escherichia coli Escherichia coli MIC > 64 ug/ml 21388139
NPT1521 Organism Stenotrophomonas maltophilia Stenotrophomonas maltophilia MIC > 64 ug/ml 21388139
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 21388139
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.12 ug/ml 21388139
NPT17 Organism Staphylococcus epidermidis Staphylococcus epidermidis MIC = 0.25 ug/ml 21388139
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 4 ug/ml 21388139
NPT1228 Organism Streptococcus pyogenes Streptococcus pyogenes MIC = 1 ug/ml 21388139
NPT16 Organism Staphylococcus aureus Staphylococcus aureus ED50 = 3 mg/kg 21388139
NPT1429 Individual Protein Heat shock protein HSP 90-beta Homo sapiens Activity = 0.7 nM 21904660
NPT4310 Individual Protein Heat shock protein HSP 90 Oryctolagus cuniculus IC50 = 350000 nM 21273068
NPT1044 Individual Protein DNA topoisomerase II alpha Homo sapiens Inhibition = 60.4 % 21419530
NPT1605 Organism Enterococcus Enterococcus MIC > 128 ug/ml 21534606
NPT1605 Organism Enterococcus Enterococcus MIC = 2 ug/ml 21534606
NPT2 Others Unspecified MIC = 8 ug/ml 21534606
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 21534606
NPT2 Others Unspecified MIC = 0.13 ug/ml 21534606
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.13 ug/ml 21534606
NPT1624 Organism Streptococcus pneumoniae R6 Streptococcus pneumoniae R6 MIC = 0.25 ug/ml 21534606
NPT1548 Organism Pseudomonas aeruginosa PAO1 Pseudomonas aeruginosa PAO1 MIC = 8 ug/ml 21534606
NPT1466 Organism Escherichia coli K12 Escherichia coli K-12 MIC = 8 ug/ml 21534606
NPT2 Others Unspecified IC50 = 50 nM 21534606
NPT2 Others Unspecified IC50 = 110 nM 21534606
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 700000 nM 21553822
NPT2 Others Unspecified Activity = 90 % 21486005
NPT2 Others Unspecified IC50 = 8 nM 21871799
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 21871799
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC = 4 ug/ml 21871799
NPT2 Others Unspecified MIC = 2 ug/ml 21871799
NPT19 Organism Escherichia coli Escherichia coli MIC = 4 ug/ml 21871799
NPT901 Individual Protein UDP-glucuronosyltransferase 1-1 Homo sapiens Activity = 0 pm/min/mg 10836148
NPT15 Cell Line Jurkat Homo sapiens Activity = 0.7 nM 22014826
NPT2 Others Unspecified IC50 = 3 nM 22444877
NPT2 Others Unspecified IC50 = 15 nM 22444877
NPT19 Organism Escherichia coli Escherichia coli Ratio = 32 22483632
NPT19 Organism Escherichia coli Escherichia coli Ratio = 64 22483632
NPT19 Organism Escherichia coli Escherichia coli MIC = 32 ug/ml 22483632
NPT2 Others Unspecified Ki = 60000 nM 22424148
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 780 nM 22814212
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 390 nM 22814212
NPT1422 Individual Protein ATP-binding cassette sub-family G member 2 Homo sapiens Activity = 3 fold 16460798
NPT1422 Individual Protein ATP-binding cassette sub-family G member 2 Homo sapiens IC50 = 25000 nM 16460798
NPT2 Others Unspecified Kd = 28 nM 22731783
NPT622 Individual Protein Solute carrier organic anion transporter family member 2B1 Homo sapiens Inhibition = 85.6 % 22541068
NPT72 Individual Protein Solute carrier organic anion transporter family member 1B3 Homo sapiens Inhibition = 84.2 % 22541068
NPT73 Individual Protein Solute carrier organic anion transporter family member 1B1 Homo sapiens Inhibition = 58.1 % 22541068
NPT2 Others Unspecified Kd = 120000 nM 21235241
NPT4943 Individual Protein DNA gyrase subunit B Escherichia coli Kd = 28 nM 21235241
NPT2 Others Unspecified IC50 = 210 nM 21235241
NPT20 Organism Candida albicans Candida albicans MIC > 32 ug/ml 23084277
NPT19 Organism Escherichia coli Escherichia coli MIC > 32 ug/ml 23084277
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 < 4 nM 23084277
NPT2 Others Unspecified IC50 = 35000 nM 23084277
NPT2 Others Unspecified IC50 = 10000 nM 23084277
NPT2 Others Unspecified IC50 = 500 nM 23084277
NPT2 Others Unspecified IC50 = 450 nM 23084277
NPT175 Organism Enterococcus faecalis Enterococcus faecalis MIC = 32 ug/ml 23084277
NPT2 Others Unspecified IC50 = 23 nM 23084277
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 16 ug/ml 23084277
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 4 ug/ml 23084277
NPT19 Organism Escherichia coli Escherichia coli MIC = 2 ug/ml 23084277
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 2 ug/ml 23084277
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 1 ug/ml 23084277
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.5 ug/ml 23084277
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.25 ug/ml 23084277
NPT1122 Organism Haemophilus influenzae Haemophilus influenzae MIC = 0.12 ug/ml 23084277
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.06 ug/ml 23084277
NPT2758 Organism Streptomyces alboniger Streptomyces alboniger IZ = 11 mm 10.1584/jpestics.28.183
NPT2758 Organism Streptomyces alboniger Streptomyces alboniger IZ = 21 mm 10.1584/jpestics.28.183
NPT2759 Organism Streptomyces acidiscabies Streptomyces acidiscabies IZ = 18 mm 10.1584/jpestics.28.183
NPT2759 Organism Streptomyces acidiscabies Streptomyces acidiscabies IZ = 14 mm 10.1584/jpestics.28.183
NPT2759 Organism Streptomyces acidiscabies Streptomyces acidiscabies IZ = 39 mm 10.1584/jpestics.28.183
NPT2760 Organism Streptomyces scabiei Streptomyces scabiei IZ = 17 mm 10.1584/jpestics.28.183
NPT2760 Organism Streptomyces scabiei Streptomyces scabiei IZ = 26 mm 10.1584/jpestics.28.183
NPT2760 Organism Streptomyces scabiei Streptomyces scabiei IZ = 44 mm 10.1584/jpestics.28.183
NPT2760 Organism Streptomyces scabiei Streptomyces scabiei IZ = 28 mm 10.1584/jpestics.28.183
NPT2 Others Unspecified Activity = 77.9 % 23441911
NPT2 Others Unspecified Activity = 78.2 % 23441911
NPT1 Others Radical scavenging activity Activity = 47.7 % 23441911
NPT79 Organism Bacillus subtilis Bacillus subtilis MIC = 16 ug/ml 23441911
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 64 ug/ml 23441911
NPT826 Organism Magnaporthe oryzae Magnaporthe oryzae MIC = 16 ug/ml 23441911
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 700000 nM 23234644
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 700000 nM 23606927
NPT19 Organism Escherichia coli Escherichia coli MIC = 32 ug/ml 23409840
NPT19 Organism Escherichia coli Escherichia coli MIC = 0.5 ug/ml 23409840
NPT83 Cell Line MCF7 Homo sapiens IC50 = 357000 nM 23859777
NPT134 Cell Line SK-BR-3 Homo sapiens IC50 = 350000 nM 23859777
NPT134 Cell Line SK-BR-3 Homo sapiens Activity = 57 % 23859777
NPT134 Cell Line SK-BR-3 Homo sapiens Activity = 38 % 23859777
NPT134 Cell Line SK-BR-3 Homo sapiens Activity = 15 % 23859777
NPT134 Cell Line SK-BR-3 Homo sapiens Activity = 10 % 23859777
NPT2 Others Unspecified FC = 1.5 23859777
NPT1044 Individual Protein DNA topoisomerase II alpha Homo sapiens Inhibition = 76.8 % 24013413
NPT1044 Individual Protein DNA topoisomerase II alpha Homo sapiens Inhibition = 63.6 % 24013413
NPT1044 Individual Protein DNA topoisomerase II alpha Homo sapiens Inhibition = 14.4 % 24013413
NPT1166 Individual Protein Angiotensin-converting enzyme Homo sapiens Ki = 167000 nM 24088053
NPT1166 Individual Protein Angiotensin-converting enzyme Homo sapiens Inhibition = 75 % 24088053
NPT2 Others Unspecified IC50 = 50 nM 24148991
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 24148991
NPT2 Others Unspecified Inhibition = 100 % 24148991
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 200 nM 24148991
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis Inhibition = 96 % 24148991
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis Inhibition = 98.2 % 24148991
NPT2 Others Unspecified IC50 = 700000 nM 24900777
NPT2 Others Unspecified Potency 18821.2 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 14950.2 nM PubChem BioAssay data set
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency 10 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 11875.4 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 5951.8 nM PubChem BioAssay data set
NPT2 Others Unspecified IC50 = 700000 nM 10.1039/C0MD00063A
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 1.95 ug/ml 24629449
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC < 1270 nM 24629449
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 0.5 ug/ml 24098982
NPT2 Others Unspecified MIC = 2 ug/ml 24098982
NPT2 Others Unspecified MIC = 1 ug/ml 24098982
NPT2 Others Unspecified MIC = 0.25 ug/ml 24098982
NPT2 Others Unspecified MIC = 4 ug/ml 24098982
NPT2 Others Unspecified Ratio = 8 24098982
NPT2 Others Unspecified Ratio = 4 24098982
NPT2 Others Unspecified Ratio = 1 24098982
NPT2 Others Unspecified Ratio = 16 24098982
NPT83 Cell Line MCF7 Homo sapiens IC50 = 260000 nM 24992077
NPT83 Cell Line MCF7 Homo sapiens GI50 = 260000 nM 24992077
NPT19 Organism Escherichia coli Escherichia coli MIC80 = 0.3 ug/ml 24746270
NPT19 Organism Escherichia coli Escherichia coli MIC80 = 0.1 ug/ml 24746270
NPT2 Others Unspecified IC50 = 700000 nM 25462258
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 180 nM 25456076
NPT2 Others Unspecified IC50 = 46 nM 25456076
NPT2 Others Unspecified IC50 = 46000 nM 25127151
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 25127151
NPT113 Cell Line RAW264.7 Mus musculus Inhibition = 29.44 % 25127151
NPT2 Others Unspecified IC50 = 700000000 nM 24953820
NPT4310 Individual Protein Heat shock protein HSP 90 Oryctolagus cuniculus IC50 = 414000 nM 24984936
NPT1429 Individual Protein Heat shock protein HSP 90-beta Homo sapiens IC50 = 231000 nM 24984936
NPT2 Others Unspecified LC50 = 690000 nM 24984936
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.13 ug/ml 25286019
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 32 ug/ml 25286019
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 4.3 ug/ml 25286019
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 1 ug/ml 25286019
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC > 16 ug/ml 25286019
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 0.13 ug/ml 25286019
NPT2 Others Unspecified Inhibition > 61 % 25127151
NPT5490 Individual Protein DNA gyrase subunit B Staphylococcus aureus IC50 = 125 nM 25288496
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 30 nM 25288496
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 250 nM 25288496
NPT2 Others Unspecified IC50 = 15 nM 25221657
NPT2 Others Unspecified IC50 = 46 nM 25129171
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 180 nM 25129171
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 25129171
NPT113 Cell Line RAW264.7 Mus musculus Inhibition = 19.36 % 25129171
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 180 nM 25801151
NPT2 Others Unspecified IC50 = 46 nM 25801151
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 25801151
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 46 nM 25766629
NPT2 Others Unspecified IC50 = 180 nM 25766629
NPT113 Cell Line RAW264.7 Mus musculus Inhibition = 81.67 % 25766629
NPT2 Others Unspecified IC50 = 700000 nM 25699150
NPT19 Organism Escherichia coli Escherichia coli MIC = 320000 nM 25941556
NPT19 Organism Escherichia coli Escherichia coli MIC = 1200 nM 25941556
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 170 nM 26098163
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 40 nM 26098163
NPT2 Others Unspecified IC50 = 11000 nM 26098163
NPT5491 Protein Complex Topoisomerase IV Staphylococcus aureus IC50 = 27000 nM 26098163
NPT2 Others Unspecified IC50 = 130 nM 26098163
NPT1567 Protein Complex DNA gyrase Escherichia coli K-12 IC50 = 80 nM 26098163
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 10 nM 26098163
NPT2 Others Unspecified IC50 = 10000 nM 26098163
NPT5491 Protein Complex Topoisomerase IV Staphylococcus aureus IC50 = 20000 nM 26098163
NPT2 Others Unspecified MIC = 2500 nM 26320664
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus MIC = 10 nM 26320664
NPT2 Others Unspecified IC50 = 46 nM 26318054
NPT5489 Individual Protein DNA gyrase subunit B Mycobacterium smegmatis IC50 = 180 nM 26318054
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 26318054
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae ED > 100 mg/kg 26487916
NPT16 Organism Staphylococcus aureus Staphylococcus aureus MIC = 0.125 ug/ml 26487916
NPT1118 Organism Streptococcus pneumoniae Streptococcus pneumoniae MIC = 2 ug/ml 26487916
NPT2 Others Unspecified IC50 = 46000 nM 26678175
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 200000 nM 26678175
NPT113 Cell Line RAW264.7 Mus musculus Inhibition = 19.3 % 26678175
NPT2 Others Unspecified IC50 = 46 nM 26787274
NPT790 Organism Mycobacterium tuberculosis H37Rv Mycobacterium tuberculosis H37Rv MIC > 50000 nM 26787274
NPT5492 Organism Proteus sp. Proteus sp. IZ = 20 mm 26833242
NPT19 Organism Escherichia coli Escherichia coli IZ = 7 mm 26833242
NPT18 Organism Pseudomonas aeruginosa Pseudomonas aeruginosa IZ = 14 mm 26833242
NPT16 Organism Staphylococcus aureus Staphylococcus aureus IZ = 24 mm 26833242
NPT2 Others Unspecified IC50 = 700000 nM 26745854
NPT2 Others Unspecified IC50 = 26700 nM 27100032
NPT2 Others Unspecified IC50 = 11100 nM 27100032
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 41 nM 27100032
NPT2 Others Unspecified IC50 = 168 nM 27100032
NPT2 Others Unspecified Kd = 28 nM 27100032
NPT2 Others Unspecified IC50 = 80 nM 27100032
NPT5484 Protein Complex DNA gyrase Staphylococcus aureus IC50 = 10 nM 27100032
NPT2 Others Unspecified IC50 = 10000 nM 27100032
NPT2 Others Unspecified IC50 = 20000 nM 27100032
NPT2 Others Unspecified Kd = 19 nM 27100032
NPT83 Cell Line MCF7 Homo sapiens IC50 = 293300 nM 27153346
NPT784 Cell Line MDA-MB-468 Homo sapiens IC50 = 338400 nM 27153346

  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 NPC257728 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
0.9946 High Similarity NPC257266
0.9839 High Similarity NPC153365
0.8254 Intermediate Similarity NPC314025
0.8115 Intermediate Similarity NPC314213
0.8115 Intermediate Similarity NPC314656
0.8073 Intermediate Similarity NPC315913
0.7865 Intermediate Similarity NPC76047
0.7789 Intermediate Similarity NPC257566
0.7789 Intermediate Similarity NPC124155
0.7789 Intermediate Similarity NPC183672
0.7773 Intermediate Similarity NPC478048
0.7766 Intermediate Similarity NPC43761
0.7766 Intermediate Similarity NPC73511
0.7737 Intermediate Similarity NPC44947
0.7737 Intermediate Similarity NPC131745
0.7736 Intermediate Similarity NPC478047
0.7736 Intermediate Similarity NPC314914
0.7736 Intermediate Similarity NPC328856
0.7736 Intermediate Similarity NPC478046
0.7736 Intermediate Similarity NPC321226
0.7736 Intermediate Similarity NPC180210
0.7725 Intermediate Similarity NPC472320
0.7713 Intermediate Similarity NPC197896
0.7713 Intermediate Similarity NPC161749
0.7713 Intermediate Similarity NPC43638
0.7713 Intermediate Similarity NPC258035
0.7713 Intermediate Similarity NPC313163
0.7713 Intermediate Similarity NPC23817
0.7713 Intermediate Similarity NPC156457
0.77 Intermediate Similarity NPC284236
0.77 Intermediate Similarity NPC316368
0.7696 Intermediate Similarity NPC66087
0.7696 Intermediate Similarity NPC278419
0.7696 Intermediate Similarity NPC179198
0.7688 Intermediate Similarity NPC469437
0.7685 Intermediate Similarity NPC83019
0.7684 Intermediate Similarity NPC101636
0.7684 Intermediate Similarity NPC303913
0.7684 Intermediate Similarity NPC47923
0.7667 Intermediate Similarity NPC92235
0.766 Intermediate Similarity NPC127406
0.766 Intermediate Similarity NPC45165
0.7656 Intermediate Similarity NPC294722
0.7644 Intermediate Similarity NPC259834
0.7644 Intermediate Similarity NPC298171
0.7644 Intermediate Similarity NPC190450
0.7635 Intermediate Similarity NPC204580
0.7635 Intermediate Similarity NPC172355
0.7629 Intermediate Similarity NPC5319
0.7628 Intermediate Similarity NPC170101
0.7622 Intermediate Similarity NPC100818
0.7622 Intermediate Similarity NPC103116
0.7622 Intermediate Similarity NPC107197
0.7614 Intermediate Similarity NPC79736
0.7614 Intermediate Similarity NPC67629
0.7606 Intermediate Similarity NPC470604
0.7606 Intermediate Similarity NPC27408
0.7606 Intermediate Similarity NPC95090
0.7606 Intermediate Similarity NPC99233
0.7606 Intermediate Similarity NPC470605
0.7606 Intermediate Similarity NPC470603
0.7604 Intermediate Similarity NPC121703
0.7602 Intermediate Similarity NPC309692
0.7592 Intermediate Similarity NPC472994
0.7592 Intermediate Similarity NPC477628
0.7592 Intermediate Similarity NPC216496
0.7592 Intermediate Similarity NPC477629
0.7592 Intermediate Similarity NPC159579
0.7592 Intermediate Similarity NPC129217
0.7592 Intermediate Similarity NPC195685
0.7592 Intermediate Similarity NPC85707
0.7592 Intermediate Similarity NPC224530
0.7592 Intermediate Similarity NPC210961
0.7592 Intermediate Similarity NPC270675
0.7592 Intermediate Similarity NPC48093
0.7592 Intermediate Similarity NPC259957
0.7579 Intermediate Similarity NPC473634
0.7579 Intermediate Similarity NPC470607
0.7579 Intermediate Similarity NPC22062
0.7579 Intermediate Similarity NPC138811
0.7577 Intermediate Similarity NPC249977
0.7576 Intermediate Similarity NPC267549
0.7566 Intermediate Similarity NPC170475
0.7566 Intermediate Similarity NPC206378
0.7565 Intermediate Similarity NPC475979
0.7565 Intermediate Similarity NPC72016
0.7565 Intermediate Similarity NPC7752
0.7565 Intermediate Similarity NPC139060
0.7563 Intermediate Similarity NPC63105
0.7563 Intermediate Similarity NPC169645
0.7563 Intermediate Similarity NPC84482
0.7553 Intermediate Similarity NPC108706
0.7553 Intermediate Similarity NPC143851
0.7553 Intermediate Similarity NPC223701
0.7553 Intermediate Similarity NPC106625
0.7553 Intermediate Similarity NPC211158
0.7553 Intermediate Similarity NPC78021
0.7553 Intermediate Similarity NPC210003
0.7553 Intermediate Similarity NPC83283
0.7553 Intermediate Similarity NPC87304
0.7553 Intermediate Similarity NPC29763
0.7553 Intermediate Similarity NPC39360
0.7553 Intermediate Similarity NPC7989
0.7553 Intermediate Similarity NPC472583
0.7553 Intermediate Similarity NPC268950
0.7552 Intermediate Similarity NPC472876
0.7552 Intermediate Similarity NPC27942
0.7545 Intermediate Similarity NPC315914
0.7539 Intermediate Similarity NPC246469
0.7539 Intermediate Similarity NPC271270
0.7539 Intermediate Similarity NPC271479
0.7539 Intermediate Similarity NPC142860
0.7539 Intermediate Similarity NPC200708
0.7539 Intermediate Similarity NPC97285
0.7539 Intermediate Similarity NPC473623
0.7526 Intermediate Similarity NPC262222
0.7526 Intermediate Similarity NPC89809
0.7526 Intermediate Similarity NPC64425
0.7526 Intermediate Similarity NPC60966
0.7526 Intermediate Similarity NPC182634
0.7526 Intermediate Similarity NPC473512
0.7526 Intermediate Similarity NPC298666
0.7526 Intermediate Similarity NPC65003
0.7526 Intermediate Similarity NPC108831
0.7526 Intermediate Similarity NPC129827
0.7526 Intermediate Similarity NPC260504
0.7526 Intermediate Similarity NPC122809
0.7526 Intermediate Similarity NPC470606
0.7526 Intermediate Similarity NPC44931
0.7526 Intermediate Similarity NPC68592
0.7526 Intermediate Similarity NPC473278
0.7525 Intermediate Similarity NPC325176
0.7513 Intermediate Similarity NPC39351
0.7513 Intermediate Similarity NPC477958
0.7513 Intermediate Similarity NPC72649
0.7513 Intermediate Similarity NPC26195
0.7513 Intermediate Similarity NPC97052
0.7513 Intermediate Similarity NPC470681
0.7513 Intermediate Similarity NPC208668
0.7513 Intermediate Similarity NPC80068
0.7513 Intermediate Similarity NPC169248
0.7513 Intermediate Similarity NPC163165
0.7512 Intermediate Similarity NPC106700
0.75 Intermediate Similarity NPC298778
0.75 Intermediate Similarity NPC150767
0.75 Intermediate Similarity NPC10807
0.75 Intermediate Similarity NPC475161
0.75 Intermediate Similarity NPC209550
0.75 Intermediate Similarity NPC88484
0.75 Intermediate Similarity NPC199079
0.75 Intermediate Similarity NPC282169
0.75 Intermediate Similarity NPC161881
0.75 Intermediate Similarity NPC210808
0.75 Intermediate Similarity NPC188815
0.75 Intermediate Similarity NPC244583
0.75 Intermediate Similarity NPC259767
0.75 Intermediate Similarity NPC259182
0.75 Intermediate Similarity NPC277532
0.75 Intermediate Similarity NPC477860
0.75 Intermediate Similarity NPC150123
0.75 Intermediate Similarity NPC121001
0.75 Intermediate Similarity NPC138990
0.75 Intermediate Similarity NPC175429
0.75 Intermediate Similarity NPC78734
0.75 Intermediate Similarity NPC256141
0.75 Intermediate Similarity NPC56232
0.7487 Intermediate Similarity NPC41121
0.7487 Intermediate Similarity NPC104677
0.7487 Intermediate Similarity NPC229729
0.7487 Intermediate Similarity NPC472459
0.7487 Intermediate Similarity NPC320283
0.7487 Intermediate Similarity NPC308265
0.7487 Intermediate Similarity NPC111929
0.7475 Intermediate Similarity NPC470454
0.7475 Intermediate Similarity NPC68381
0.7475 Intermediate Similarity NPC199533
0.7474 Intermediate Similarity NPC471787
0.7474 Intermediate Similarity NPC129264
0.7474 Intermediate Similarity NPC19240
0.7474 Intermediate Similarity NPC149368
0.7474 Intermediate Similarity NPC473657
0.7474 Intermediate Similarity NPC307938
0.7474 Intermediate Similarity NPC323593
0.7474 Intermediate Similarity NPC203500
0.7474 Intermediate Similarity NPC261866
0.7474 Intermediate Similarity NPC17521
0.7474 Intermediate Similarity NPC265480
0.7474 Intermediate Similarity NPC295613
0.7474 Intermediate Similarity NPC205824
0.7474 Intermediate Similarity NPC85751
0.7462 Intermediate Similarity NPC137871
0.7462 Intermediate Similarity NPC235575
0.7462 Intermediate Similarity NPC9002
0.7462 Intermediate Similarity NPC221288
0.7462 Intermediate Similarity NPC257011
0.7462 Intermediate Similarity NPC256760
0.7462 Intermediate Similarity NPC101399
0.7462 Intermediate Similarity NPC11847
0.7462 Intermediate Similarity NPC288152
0.7462 Intermediate Similarity NPC474522

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC257728 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 NPD7585 Approved
0.9946 High Similarity NPD7583 Approved
0.9418 High Similarity NPD7584 Approved
0.7713 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7677 Intermediate Similarity NPD3863 Clinical (unspecified phase)
0.7674 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7629 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7783 Phase 2
0.7487 Intermediate Similarity NPD5940 Clinical (unspecified phase)
0.7474 Intermediate Similarity NPD3451 Clinical (unspecified phase)
0.744 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7435 Intermediate Similarity NPD7075 Discontinued
0.7424 Intermediate Similarity NPD5192 Clinical (unspecified phase)
0.7416 Intermediate Similarity NPD7597 Clinical (unspecified phase)
0.7394 Intermediate Similarity NPD4380 Phase 2
0.7391 Intermediate Similarity NPD7811 Phase 3
0.7391 Intermediate Similarity NPD7810 Phase 3
0.7387 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.736 Intermediate Similarity NPD7054 Approved
0.7323 Intermediate Similarity NPD7074 Phase 3
0.7323 Intermediate Similarity NPD7472 Approved
0.7315 Intermediate Similarity NPD7930 Approved
0.7277 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD7701 Phase 2
0.7265 Intermediate Similarity NPD8059 Phase 3
0.7265 Intermediate Similarity NPD8058 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD7039 Approved
0.725 Intermediate Similarity NPD6559 Discontinued
0.725 Intermediate Similarity NPD7251 Discontinued
0.725 Intermediate Similarity NPD7038 Approved
0.7245 Intermediate Similarity NPD5242 Approved
0.7243 Intermediate Similarity NPD8151 Discontinued
0.723 Intermediate Similarity NPD6973 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD6801 Discontinued
0.7222 Intermediate Similarity NPD3818 Discontinued
0.7214 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7214 Intermediate Similarity NPD7808 Phase 3
0.7204 Intermediate Similarity NPD6823 Phase 2
0.7202 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.72 Intermediate Similarity NPD3823 Discontinued
0.72 Intermediate Similarity NPD6797 Phase 2
0.7198 Intermediate Similarity NPD4360 Phase 2
0.7198 Intermediate Similarity NPD4363 Phase 3
0.719 Intermediate Similarity NPD6777 Approved
0.719 Intermediate Similarity NPD6780 Approved
0.719 Intermediate Similarity NPD6782 Approved
0.719 Intermediate Similarity NPD6781 Approved
0.719 Intermediate Similarity NPD6778 Approved
0.719 Intermediate Similarity NPD6776 Approved
0.719 Intermediate Similarity NPD6779 Approved
0.7183 Intermediate Similarity NPD7999 Approved
0.7176 Intermediate Similarity NPD7801 Approved
0.7171 Intermediate Similarity NPD7235 Clinical (unspecified phase)
0.717 Intermediate Similarity NPD7696 Phase 3
0.717 Intermediate Similarity NPD7698 Approved
0.717 Intermediate Similarity NPD7697 Approved
0.7149 Intermediate Similarity NPD8152 Approved
0.7149 Intermediate Similarity NPD8153 Approved
0.7136 Intermediate Similarity NPD8319 Approved
0.7136 Intermediate Similarity NPD8320 Phase 1
0.7136 Intermediate Similarity NPD7871 Phase 2
0.7136 Intermediate Similarity NPD7870 Phase 2
0.713 Intermediate Similarity NPD7874 Approved
0.713 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7123 Intermediate Similarity NPD5006 Approved
0.7123 Intermediate Similarity NPD5005 Approved
0.7121 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.71 Intermediate Similarity NPD5844 Phase 1
0.7089 Intermediate Similarity NPD7435 Discontinued
0.7083 Intermediate Similarity NPD7411 Suspended
0.7081 Intermediate Similarity NPD7667 Clinical (unspecified phase)
0.7053 Intermediate Similarity NPD3808 Clinical (unspecified phase)
0.7031 Intermediate Similarity NPD6625 Approved
0.7019 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7014 Intermediate Similarity NPD3949 Clinical (unspecified phase)
0.7014 Intermediate Similarity NPD4420 Approved
0.701 Intermediate Similarity NPD8455 Phase 2
0.701 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.701 Intermediate Similarity NPD7819 Suspended
0.7009 Intermediate Similarity NPD7064 Clinical (unspecified phase)
0.7005 Intermediate Similarity NPD6377 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD4362 Clinical (unspecified phase)
0.7 Intermediate Similarity NPD4361 Phase 2
0.6985 Remote Similarity NPD2388 Discontinued
0.6981 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6981 Remote Similarity NPD8285 Discontinued
0.6974 Remote Similarity NPD8443 Clinical (unspecified phase)
0.6965 Remote Similarity NPD7177 Discontinued
0.696 Remote Similarity NPD8469 Approved
0.6952 Remote Similarity NPD4413 Clinical (unspecified phase)
0.6952 Remote Similarity NPD6534 Approved
0.6952 Remote Similarity NPD6535 Approved
0.6948 Remote Similarity NPD5457 Discontinued
0.6947 Remote Similarity NPD7410 Clinical (unspecified phase)
0.6947 Remote Similarity NPD4378 Clinical (unspecified phase)
0.6937 Remote Similarity NPD8404 Phase 2
0.6934 Remote Similarity NPD7700 Phase 2
0.6934 Remote Similarity NPD7699 Phase 2
0.6933 Remote Similarity NPD6997 Phase 2
0.6919 Remote Similarity NPD7880 Clinical (unspecified phase)
0.6912 Remote Similarity NPD6104 Discontinued
0.6908 Remote Similarity NPD6793 Clinical (unspecified phase)
0.6907 Remote Similarity NPD7615 Clinical (unspecified phase)
0.6905 Remote Similarity NPD6214 Clinical (unspecified phase)
0.6905 Remote Similarity NPD6213 Phase 3
0.6905 Remote Similarity NPD4466 Phase 1
0.6905 Remote Similarity NPD6212 Phase 3
0.6904 Remote Similarity NPD8005 Clinical (unspecified phase)
0.6893 Remote Similarity NPD6851 Approved
0.6893 Remote Similarity NPD6853 Approved
0.6875 Remote Similarity NPD5403 Approved
0.6875 Remote Similarity NPD1898 Discontinued
0.6872 Remote Similarity NPD1934 Approved
0.6867 Remote Similarity NPD7048 Phase 3
0.6866 Remote Similarity NPD6166 Phase 2
0.6866 Remote Similarity NPD4575 Clinical (unspecified phase)
0.6866 Remote Similarity NPD7852 Clinical (unspecified phase)
0.6866 Remote Similarity NPD6167 Clinical (unspecified phase)
0.6866 Remote Similarity NPD6168 Clinical (unspecified phase)
0.6863 Remote Similarity NPD7993 Clinical (unspecified phase)
0.6857 Remote Similarity NPD3819 Phase 2
0.6853 Remote Similarity NPD7768 Phase 2
0.685 Remote Similarity NPD7608 Discontinued
0.6845 Remote Similarity NPD8312 Approved
0.6845 Remote Similarity NPD8313 Approved
0.6839 Remote Similarity NPD1653 Approved
0.6837 Remote Similarity NPD7476 Discontinued
0.6834 Remote Similarity NPD2904 Discontinued
0.6833 Remote Similarity NPD7827 Phase 1
0.6831 Remote Similarity NPD8461 Discontinued
0.6829 Remote Similarity NPD7685 Pre-registration
0.6825 Remote Similarity NPD4628 Phase 3
0.6825 Remote Similarity NPD3750 Approved
0.6822 Remote Similarity NPD7565 Approved
0.6821 Remote Similarity NPD5889 Approved
0.6821 Remote Similarity NPD5890 Approved
0.6816 Remote Similarity NPD7047 Phase 3
0.6814 Remote Similarity NPD8366 Approved
0.6809 Remote Similarity NPD1549 Phase 2
0.6808 Remote Similarity NPD6621 Clinical (unspecified phase)
0.6808 Remote Similarity NPD7238 Clinical (unspecified phase)
0.6806 Remote Similarity NPD6799 Approved
0.6804 Remote Similarity NPD8158 Clinical (unspecified phase)
0.6802 Remote Similarity NPD3817 Phase 2
0.6802 Remote Similarity NPD5402 Approved
0.6797 Remote Similarity NPD8067 Phase 3
0.6794 Remote Similarity NPD7693 Approved
0.6772 Remote Similarity NPD2976 Clinical (unspecified phase)
0.6772 Remote Similarity NPD7421 Clinical (unspecified phase)
0.6771 Remote Similarity NPD7447 Phase 1
0.6771 Remote Similarity NPD5401 Approved
0.6769 Remote Similarity NPD6585 Discontinued
0.6769 Remote Similarity NPD8491 Approved
0.6765 Remote Similarity NPD42 Phase 2
0.6765 Remote Similarity NPD6042 Phase 2
0.6755 Remote Similarity NPD1552 Clinical (unspecified phase)
0.6755 Remote Similarity NPD1550 Clinical (unspecified phase)
0.6754 Remote Similarity NPD6667 Approved
0.6754 Remote Similarity NPD6666 Approved
0.6751 Remote Similarity NPD1465 Phase 2
0.675 Remote Similarity NPD2042 Clinical (unspecified phase)
0.675 Remote Similarity NPD5677 Discontinued
0.675 Remote Similarity NPD2041 Clinical (unspecified phase)
0.675 Remote Similarity NPD4666 Phase 3
0.6746 Remote Similarity NPD8150 Discontinued
0.6745 Remote Similarity NPD6181 Discontinued
0.6744 Remote Similarity NPD6874 Approved
0.6735 Remote Similarity NPD6677 Suspended
0.6735 Remote Similarity NPD6072 Discontinued
0.6731 Remote Similarity NPD7090 Clinical (unspecified phase)
0.6719 Remote Similarity NPD7213 Phase 3
0.6719 Remote Similarity NPD7212 Phase 2
0.6718 Remote Similarity NPD7458 Discontinued
0.6717 Remote Similarity NPD7318 Phase 3
0.6717 Remote Similarity NPD5353 Approved
0.6716 Remote Similarity NPD7228 Approved
0.6714 Remote Similarity NPD3473 Clinical (unspecified phase)
0.6714 Remote Similarity NPD7256 Discontinued
0.6702 Remote Similarity NPD2796 Approved
0.6701 Remote Similarity NPD4433 Discontinued
0.67 Remote Similarity NPD5709 Phase 3
0.6699 Remote Similarity NPD6297 Approved
0.6685 Remote Similarity NPD6859 Clinical (unspecified phase)
0.6684 Remote Similarity NPD3536 Discontinued
0.6684 Remote Similarity NPD6599 Discontinued
0.6683 Remote Similarity NPD5711 Approved
0.6683 Remote Similarity NPD5710 Approved
0.6683 Remote Similarity NPD6020 Phase 2
0.6682 Remote Similarity NPD7566 Clinical (unspecified phase)
0.6667 Remote Similarity NPD5124 Phase 1
0.6667 Remote Similarity NPD2801 Approved
0.6667 Remote Similarity NPD3366 Approved
0.6667 Remote Similarity NPD5123 Clinical (unspecified phase)
0.6652 Remote Similarity NPD2899 Discontinued
0.6651 Remote Similarity NPD8090 Clinical (unspecified phase)
0.6651 Remote Similarity NPD8162 Phase 2
0.6651 Remote Similarity NPD6863 Phase 2
0.6651 Remote Similarity NPD8163 Clinical (unspecified phase)
0.665 Remote Similarity NPD7975 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   54675769
ChEMBL   CHEMBL36506
ZINC  

Physicochemical Properties

Molecular Weight:  612.23
ALogP:  1.0151
MLogP:  3.44
XLogP:  4.956
# Rotatable Bonds:  20
Polar Surface Area:  197.09
# H-Bond Aceptor:  10
# H-Bond Donor:  6
# Rings:  4
# Heavy Atoms:  44

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Structure MOL file  
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Biological Activities  
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