Natural Product: NPC85707

Natural Product ID:  NPC85707
Common Name:   Sl-0101
IUPAC Name:   [(2S,3S,4S,5R,6S)-4-acetyloxy-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-5-hydroxy-2-methyloxan-3-yl] acetate
Synonyms:   SL-0101
Molecular Formula:   C25H24O12
Standard InCHIKey:  SXOZSDJHGMAEGZ-IGKKHSBFSA-N
Standard InCHI:  InChI=1S/C25H24O12/c1-10-21(34-11(2)26)24(35-12(3)27)20(32)25(33-10)37-23-19(31)18-16(30)8-15(29)9-17(18)36-22(23)13-4-6-14(28)7-5-13/h4-10,20-21,24-25,28-30,32H,1-3H3/t10-,20+,21-,24-,25-/m0/s1
Canonical SMILES:  CC(=O)O[C@H]1[C@H](C)O[C@H]([C@@H]([C@@H]1OC(=O)C)O)Oc1c(oc2c(c1=O)c(O)cc(c2)O)c1ccc(cc1)O
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
NPO12458 Zingiber aromaticum Species Zingiberaceae Eukaryota PMID[15270556]
NPO33471 Zingiber spectabile Species Zingiberaceae Eukaryota Rhizomes PMID[22546674]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1427 Individual Protein c-Jun N-terminal kinase 2 Homo sapiens Activity = 94 % 19453174
NPT1354 Cell Line TGBC11TKB Homo sapiens IC50 = 374800.92 nM 23354071
NPT1426 Individual Protein c-Jun N-terminal kinase 1 Homo sapiens Activity = 95 % 8487254
NPT2283 Cell Line DK-MG Homo sapiens IC50 = 617597.53 nM 6195312
NPT1904 Cell Line ES3 Homo sapiens IC50 = 349116.26 nM 20363140
NPT391 Cell Line HCC 2998 Homo sapiens IC50 = 52707.09 nM 20643902
NPT311 Cell Line SK-LU-1 Homo sapiens IC50 = 14254.28 nM 23707051
NPT2285 Cell Line COR-L105 Homo sapiens IC50 = 667061.34 nM 18298080
NPT2268 Cell Line DOK Homo sapiens IC50 = 67535 nM 11374975
NPT2119 Cell Line KINGS-1 Homo sapiens IC50 = 815568.16 nM 19459694
NPT1902 Cell Line ES1 Homo sapiens IC50 = 626391.77 nM 19459694
NPT2403 Cell Line SBC-5 Homo sapiens IC50 = 864644.12 nM 19459694
NPT2001 Cell Line JAR Homo sapiens IC50 = 954235.03 nM 24844534
NPT2328 Cell Line COLO-678 Homo sapiens IC50 = 490591.1 nM 12088440
NPT2401 Cell Line PANC-03-27 Homo sapiens IC50 = 282056.95 nM 1791475
NPT2040 Cell Line P30-OHK Homo sapiens IC50 = 474826.75 nM 22608855
NPT1773 Cell Line ME-180 Homo sapiens IC50 = 80575.05 nM 9733489
NPT2205 Cell Line IST-MEL1 Homo sapiens IC50 = 619029.54 nM 20853847
NPT1958 Cell Line A388 Homo sapiens IC50 = 500443.65 nM 18492609
NPT2210 Cell Line NB10 Homo sapiens IC50 = 290899.25 nM 25945867
NPT2201 Cell Line SK-LMS-1 Homo sapiens IC50 = 854077.55 nM 20329739
NPT1086 Cell Line SK-HEP1 Homo sapiens IC50 = 393685.36 nM 17958396
NPT1933 Cell Line CW-2 Homo sapiens IC50 = 431923.29 nM 17988097
NPT2126 Cell Line NKM-1 Homo sapiens IC50 = 41065.16 nM PubChem BioAssay data set
NPT1938 Cell Line Calu-6 Homo sapiens IC50 = 757456.42 nM 22691179
NPT83 Cell Line MCF7 Homo sapiens IC50 = 436888.93 nM 13678412
NPT2322 Cell Line CHL-1 Homo sapiens IC50 = 42063.78 nM 8946741
NPT2279 Cell Line COLO-792 Homo sapiens IC50 = 736345.91 nM 23985009
NPT2190 Cell Line GB-1 Homo sapiens IC50 = 354985.88 nM 24195466
NPT1924 Cell Line AM-38 Homo sapiens IC50 = 59752.2 nM PubChem BioAssay data set
NPT1653 Cell Line WM-115 Homo sapiens IC50 = 413305.9 nM 10.1016/j.cropro.2012.04.001
NPT2379 Cell Line P12-Ichikawa Homo sapiens IC50 = 388167.91 nM 18763827
NPT2474 Cell Line MDA-MB-415 Homo sapiens IC50 = 474398.65 nM 19874044
NPT1920 Cell Line ALL-PO Homo sapiens IC50 = 103425.86 nM 11678655
NPT1922 Cell Line COR-L88 Homo sapiens IC50 = 139648 nM 15084123
NPT1990 Cell Line J-RT3-T3-5 Homo sapiens IC50 = 16856.7 nM 23964644
NPT2100 Cell Line KG-1 IC50 = 22032.6 nM 18479163
NPT3291 Individual Protein Serine/threonine-protein kinase SRPK1 Homo sapiens Activity = 96 % 10498214
NPT2180 Cell Line LC-2-ad Homo sapiens IC50 = 51974.23 nM 26331426
NPT395 Cell Line SF-268 Homo sapiens IC50 = 423466.75 nM PubChem BioAssay data set
NPT1083 Cell Line A-375 Homo sapiens IC50 = 42196.36 nM PubChem BioAssay data set
NPT3344 Individual Protein BR serine/threonine-protein kinase 2 Homo sapiens Activity = 80 % 16643054
NPT1441 Individual Protein MAP kinase-activated protein kinase 2 Homo sapiens Activity = 95 % 12932142
NPT2434 Cell Line TCC-SUP Homo sapiens IC50 = 107842.52 nM 18817444
NPT550 Cell Line T-24 Homo sapiens IC50 = 582116.15 nM 7528786
NPT1358 Cell Line LAMA-84 Homo sapiens IC50 = 69931.56 nM 22871217
NPT2021 Cell Line LS-411N Homo sapiens IC50 = 596264.29 nM 8699183
NPT2369 Cell Line NCI-H2052 Homo sapiens IC50 = 660912.86 nM 17958396
NPT2450 Cell Line NCI-H2452 Homo sapiens IC50 = 197086.95 nM 17958396
NPT2068 Cell Line L-363 Homo sapiens IC50 = 66048.94 nM 17958396
NPT2099 Cell Line KE-37 Homo sapiens IC50 = 33819.11 nM 17958396
NPT1991 Cell Line KU812 cell line IC50 = 239034.76 nM 17896816
NPT994 Cell Line ZR-75-30 Homo sapiens IC50 = 444817.02 nM 9514009
NPT2352 Cell Line MHH-ES-1 Homo sapiens IC50 = 198540.28 nM 19572611
NPT3409 Individual Protein Homeodomain-interacting protein kinase 3 Homo sapiens Activity = 110 % PubChem BioAssay data set
NPT308 Cell Line CAKI-1 Homo sapiens IC50 = 230529.08 nM 11689077
NPT1900 Cell Line DU-4475 Homo sapiens IC50 = 7649.48 nM 19182783
NPT3206 Individual Protein Serine/threonine-protein kinase Aurora-C Homo sapiens Activity = 77 % PubChem BioAssay data set
NPT1031 Cell Line Ca9-22 Homo sapiens IC50 = 452412.78 nM 8450319
NPT2000 Cell Line GR-ST Homo sapiens IC50 = 630639.89 nM 18672931
NPT2318 Cell Line A172 Homo sapiens IC50 = 4771.72 nM 8946745
NPT2161 Cell Line no-11 Homo sapiens IC50 = 329140.27 nM 22304344
NPT2377 Cell Line NCI-H2087 Homo sapiens IC50 = 345544.7 nM 23131412
NPT2189 Cell Line TE-9 Homo sapiens IC50 = 283366.18 nM 23131412
NPT2387 Cell Line KYSE-410 Homo sapiens IC50 = 247799.51 nM 24461297
NPT2162 Cell Line HCE-T Homo sapiens IC50 = 82209.51 nM 9873511
NPT1344 Individual Protein Serine/threonine-protein kinase EEF2K Homo sapiens Activity = 86 % 18419154
NPT372 Cell Line HOP-92 Homo sapiens IC50 = 56608.21 nM 12932130
NPT2407 Cell Line HCC1419 Homo sapiens IC50 = 64736.23 nM 19969457
NPT147 Cell Line SK-MEL-2 Homo sapiens IC50 = 886270.31 nM 18247573
NPT1669 Cell Line NCI-H1792 Homo sapiens IC50 = 479818.06 nM 21856049
NPT2349 Cell Line HMV-2 cell line IC50 = 250034.27 nM 11325246
NPT3399 Individual Protein Dual-specificity tyrosine-phosphorylation regulated kinase 2 Homo sapiens Activity = 89 % 18479163
NPT2365 Cell Line HO-1-N-1 Homo sapiens IC50 = 363636.59 nM 15043446
NPT3467 Cell Line SJRH30 Homo sapiens IC50 = 732258.07 nM 12852746
NPT2392 Cell Line S-117 Homo sapiens IC50 = 755358.9 nM 21907579
NPT2082 Cell Line HT-144 Homo sapiens IC50 = 516957.67 nM 17043127
NPT1081 Cell Line BXPC-3 Homo sapiens IC50 = 1257718.95 nM 18674917
NPT2055 Cell Line ML-2 Homo sapiens IC50 = 120534.62 nM 19231179
NPT2441 Cell Line NCI-H2347 Homo sapiens IC50 = 1038457.79 nM 17620378
NPT2034 Cell Line LU-134-A Homo sapiens IC50 = 42716.96 nM 17620378
NPT2178 Cell Line KNS-81-FD Homo sapiens IC50 = 805730.24 nM 18547811
NPT2311 Cell Line Calu-3 Homo sapiens IC50 = 261759.2 nM 20675019
NPT2389 Cell Line NCI-H1048 Homo sapiens IC50 = 448659.39 nM PubChem BioAssay data set
NPT112 Cell Line MOLT-4 Homo sapiens IC50 = 35637.2 nM 21093119
NPT2149 Cell Line MZ1-PC Homo sapiens IC50 = 104280.88 nM 21481593
NPT3107 Individual Protein Rho-associated protein kinase 2 Homo sapiens Activity = 109 % DrugMatrix in vitro pharmacology data
NPT2396 Cell Line KYSE-510 Homo sapiens IC50 = 190025.26 nM DrugMatrix in vitro pharmacology data
NPT83 Cell Line MCF7 Homo sapiens IC50 = 45600 nM DrugMatrix in vitro pharmacology data
NPT2397 Cell Line KYSE-520 cell line IC50 = 343988.42 nM DrugMatrix in vitro pharmacology data
NPT3213 Individual Protein MAP kinase signal-integrating kinase 2 Homo sapiens Activity = 97 % 22995772
NPT1265 Individual Protein Serine/threonine-protein kinase PIM1 Homo sapiens Activity = 71 % 10.1007/s00044-011-9842-7
NPT1452 Cell Line C8166 Homo sapiens IC50 = 530277.26 nM 10.1007/s00044-011-9842-7
NPT2191 Cell Line GCIY Homo sapiens IC50 = 367484.08 nM 10.1007/s00044-011-9605-5
NPT394 Cell Line EKVX Homo sapiens IC50 = 426347.18 nM 10.1007/s00044-012-0026-x
NPT2368 Cell Line NCI-H2030 Homo sapiens IC50 = 833902.93 nM 10.1007/s00044-012-0320-7
NPT2316 Cell Line CFPAC-1 Homo sapiens IC50 = 333270.68 nM Open TG-GATES in vivo data: Hematology
NPT323 Cell Line SW-620 Homo sapiens IC50 = 111037.17 nM Open TG-GATES in vivo data: Hematology
NPT381 Cell Line OVCAR-8 Homo sapiens IC50 = 192109.4 nM Open TG-GATES in vivo data: Hematology
NPT1915 Cell Line COLO-829 Homo sapiens IC50 = 109094.01 nM Open TG-GATES in vivo data: Organ Weight
NPT2045 Cell Line ETK-1 Homo sapiens IC50 = 780422.16 nM Open TG-GATES in vivo data: Organ Weight
NPT3363 Individual Protein Mitogen-activated protein kinase 15 Homo sapiens Activity = 89 % Open TG-GATES in vivo data: Organ Weight
NPT2497 Cell Line HEC-1 Homo sapiens IC50 = 575901.13 nM Open TG-GATES in vivo data: Biochemistry
NPT2118 Cell Line KGN Homo sapiens IC50 = 214423.49 nM Open TG-GATES in vivo data: Biochemistry
NPT3813 Individual Protein Tyrosine-protein kinase SRC Gallus gallus Activity = 105 % Open TG-GATES in vivo data: Biochemistry
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens IC50 = 89 nM Open TG-GATES in vivo data: Biochemistry
NPT390 Cell Line LOX IMVI Homo sapiens IC50 = 573436.38 nM Open TG-GATES in vivo data: Biochemistry
NPT1082 Cell Line NCI-H2126 Homo sapiens IC50 = 701043.54 nM DrugMatrix in vivo data: Pathology
NPT2420 Cell Line NCI-H2291 Homo sapiens IC50 = 334496.03 nM DrugMatrix in vivo data: Pathology
NPT402 Cell Line Hs-578T Homo sapiens IC50 = 120872.59 nM DrugMatrix in vivo data: Pathology
NPT2340 Cell Line KU-19-19 Homo sapiens IC50 = 495973.25 nM DrugMatrix in vivo data: Pathology
NPT2338 Cell Line SW48 Homo sapiens IC50 = 86257.15 nM DrugMatrix in vivo data: Hematology
NPT2069 Cell Line Lu-65 Homo sapiens IC50 = 101139.42 nM 24398288
NPT2476 Cell Line NCI-H441 Homo sapiens IC50 = 423951.47 nM 15646539
NPT2424 Cell Line T84 Homo sapiens IC50 = 609867.06 nM 17844993
NPT2469 Cell Line G-401 Homo sapiens IC50 = 1065777.65 nM 1336040
NPT2155 Cell Line SHP77 Homo sapiens IC50 = 26520.92 nM 16441059
NPT1125 Cell Line T98G Homo sapiens IC50 = 584559.17 nM 18288805
NPT2506 Cell Line RO82-W-1 Homo sapiens IC50 = 150372.87 nM 11473423
NPT1967 Cell Line NCI-H526 Homo sapiens IC50 = 17987.84 nM 12617583
NPT1926 Cell Line CP66-MEL Homo sapiens IC50 = 282292.28 nM 21106454
NPT2062 Cell Line SCC-15 Homo sapiens IC50 = 224690.75 nM 16933872
NPT2150 Cell Line NCI-H1648 Homo sapiens IC50 = 49133.3 nM 23501116
NPT2182 Cell Line Mo Homo sapiens IC50 = 211730.03 nM 15165148
NPT457 Cell Line BT-549 Homo sapiens IC50 = 801272.43 nM 23992864
NPT2451 Cell Line NCI-H28 Homo sapiens IC50 = 822971.85 nM 17685651
NPT2091 Cell Line SNU-5 Homo sapiens IC50 = 60807.8 nM 12932139
NPT2326 Cell Line BT-20 Homo sapiens IC50 = 796836.09 nM 8350093
NPT2465 Cell Line NCI-H1623 Homo sapiens IC50 = 1297418.76 nM 9722495
NPT2463 Cell Line MDA-MB-157 Homo sapiens IC50 = 714100.71 nM 23734701
NPT398 Cell Line UACC-62 Homo sapiens IC50 = 274315.53 nM 12431048
NPT2111 Cell Line SF-126 Homo sapiens IC50 = 385877.51 nM 14761187
NPT1960 Cell Line BV-173 Homo sapiens IC50 = 3014.12 nM 3397991
NPT2175 Cell Line GAK Homo sapiens IC50 = 754966.97 nM 10757717
NPT2464 Cell Line MDA-MB-175-VII Homo sapiens IC50 = 600078.21 nM 20014752
NPT384 Cell Line TK-10 Homo sapiens IC50 = 138704.25 nM DrugMatrix in vitro pharmacology data
NPT2386 Cell Line KYSE-270 Homo sapiens IC50 = 302765.02 nM DrugMatrix in vitro pharmacology data
NPT1312 Cell Line SW1990 Homo sapiens IC50 = 654955.31 nM 1356264
NPT2132 Cell Line EOL1 Homo sapiens IC50 = 62764.71 nM DrugMatrix in vivo data: Pathology
NPT2133 Cell Line KM-H2 Homo sapiens IC50 = 82388.18 nM DrugMatrix in vivo data: Hematology
NPT1913 Cell Line DJM-1 Homo sapiens IC50 = 606982.52 nM 226705
NPT2504 Cell Line NCI-H1755 Homo sapiens IC50 = 793271.08 nM 12542359
NPT2388 Cell Line LU-135 Homo sapiens IC50 = 34840.83 nM 12713403
NPT2016 Cell Line ES6 Homo sapiens IC50 = 1044949.67 nM 16872137
NPT2116 Cell Line HCC2218 Homo sapiens IC50 = 3837.08 nM 23153007
NPT2492 Cell Line OAW-42 Homo sapiens IC50 = 766826.06 nM 22276679
NPT2188 Cell Line SJSA-1 Homo sapiens IC50 = 407618.63 nM PubChem BioAssay data set
NPT2443 Cell Line SNU-449 Homo sapiens IC50 = 395122.56 nM 16472241
NPT2427 Cell Line HCC1954 Homo sapiens IC50 = 25661.66 nM PubChem BioAssay data set
NPT1433 Individual Protein Serine/threonine-protein kinase Aurora-B Homo sapiens Activity = 45 % 23571415
NPT2310 Cell Line CaR-1 Homo sapiens IC50 = 210950.39 nM PubChem BioAssay data set
NPT2353 Cell Line NCI-H1993 Homo sapiens IC50 = 828413.15 nM 15730243
NPT3282 Individual Protein Maternal embryonic leucine zipper kinase Homo sapiens Activity = 102 % 15270579
NPT2042 Cell Line SBC-1 Homo sapiens IC50 = 10043.19 nM 23869482
NPT2207 Cell Line KP-N-YN Homo sapiens IC50 = 97572.82 nM 23859780
NPT458 Cell Line IGROV-1 Homo sapiens IC50 = 1091380.84 nM 11325241
NPT281 Individual Protein MAP kinase ERK1 Homo sapiens Activity = 98 % 10479293
NPT2108 Cell Line QIMR-WIL Homo sapiens IC50 = 150043.61 nM PubChem BioAssay data set
NPT788 Cell Line SNU1 Homo sapiens IC50 = 47804.75 nM 11434317
NPT2160 Cell Line no-10 Homo sapiens IC50 = 80695.03 nM 24216090
NPT2462 Cell Line HuO9 Homo sapiens IC50 = 508459.72 nM 24387625
NPT1962 Cell Line DB Homo sapiens IC50 = 96740.29 nM PubChem BioAssay data set
NPT2459 Cell Line HCC70 Homo sapiens IC50 = 80757.67 nM 10.6019/CHEMBL1201861
NPT455 Cell Line NCI-H522 Homo sapiens IC50 = 157100.07 nM 9392880
NPT1608 Individual Protein Serine/threonine-protein kinase Chk1 Homo sapiens Activity = 82 % 18163590
NPT2356 Cell Line NCI-H661 Homo sapiens IC50 = 235243.94 nM 19783438
NPT2275 Cell Line EGI-1 Homo sapiens IC50 = 56585.51 nM 26351041
NPT2467 Cell Line RERF-LC-MS Homo sapiens IC50 = 972626.36 nM 24645629
NPT1430 Individual Protein Serine/threonine-protein kinase AKT2 Homo sapiens Activity = 99 % 19702283
NPT306 Cell Line PC-3 Homo sapiens IC50 = 239301.68 nM 24972328
NPT2304 Cell Line CAL-72 Homo sapiens IC50 = 3885.27 nM 1965654
NPT2071 Cell Line MMAC-SF Homo sapiens IC50 = 665558.81 nM 10425121
NPT2345 Cell Line SW626 Homo sapiens IC50 = 322608.01 nM 23978065
NPT2458 Cell Line FTC-133 Homo sapiens IC50 = 572594.05 nM 10775404
NPT2130 Cell Line TE-10 Homo sapiens IC50 = 431357.41 nM 24224843
NPT2176 Cell Line HD-MY-Z Homo sapiens IC50 = 992099.1 nM 9644083
NPT2294 Cell Line 23132-87 Homo sapiens IC50 = 452453.5 nM 20949916
NPT1939 Cell Line 8-MG-BA Homo sapiens IC50 = 289951.89 nM 23819871
NPT2483 Cell Line SW13 Homo sapiens IC50 = 112469.94 nM 23819871
NPT2078 Cell Line SK-UT-1 Homo sapiens IC50 = 614362.41 nM 24593182
NPT2419 Cell Line HT-1376 Homo sapiens IC50 = 943608.16 nM 19716307
NPT1506 Cell Line SK-MES-1 Homo sapiens IC50 = 265661.78 nM PubChem BioAssay data set
NPT2501 Cell Line MEL-HO Homo sapiens IC50 = 659677.45 nM 10924162
NPT139 Cell Line HT-29 Homo sapiens IC50 = 1067692.44 nM 10924160
NPT2416 Cell Line UACC-893 Homo sapiens IC50 = 767293.97 nM 16933872
NPT148 Cell Line HCT-15 Homo sapiens IC50 = 871526.26 nM 16933872
NPT2302 Cell Line 639-V Homo sapiens IC50 = 45868.43 nM PubChem BioAssay data set
NPT2014 Cell Line SW872 Homo sapiens IC50 = 1023168.03 nM 14738391
NPT146 Cell Line SK-OV-3 Homo sapiens IC50 = 261516.92 nM 8676127
NPT196 Cell Line AGS Homo sapiens IC50 = 482504.86 nM 10924160
NPT2065 Cell Line EW-1 Homo sapiens IC50 = 359865.37 nM 10924160
NPT591 Individual Protein Glycogen synthase kinase-3 beta Homo sapiens Activity = 87 % 18723353
NPT2031 Cell Line ES8 Homo sapiens IC50 = 1203629.68 nM 23621840
NPT2051 Cell Line K5 Homo sapiens IC50 = 579387.2 nM 8350085
NPT2490 Cell Line NCI-H1666 Homo sapiens IC50 = 241665.85 nM 15104503
NPT3460 Individual Protein Dual-specificity tyrosine-phosphorylation regulated kinase 3 Homo sapiens Activity = 85 % 25211032
NPT1658 Individual Protein Serine/threonine-protein kinase NEK2 Homo sapiens Activity = 101 % 21044847
NPT2296 Cell Line AU565 Homo sapiens IC50 = 592346.05 nM 15043446
NPT2107 Cell Line PSN1 Homo sapiens IC50 = 137335.39 nM 10514310
NPT2512 Cell Line LCLC-97TM1 Homo sapiens IC50 = 792336.36 nM 20095629
NPT2445 Cell Line YH-13 Homo sapiens IC50 = 680159.96 nM 19902967
NPT2509 Cell Line SW1783 Homo sapiens IC50 = 401797.81 nM 19361174
NPT2319 Cell Line A204 Homo sapiens IC50 = 81636.3 nM 23911853
NPT1973 Cell Line IST-SL1 Homo sapiens IC50 = 260923.43 nM 15270571
NPT1979 Cell Line NB13 Homo sapiens IC50 = 634524.56 nM 18278869
NPT2023 Cell Line NB7 Homo sapiens IC50 = 278024.71 nM 15568794
NPT2088 Cell Line MOLT-16 Homo sapiens IC50 = 505550.53 nM 17346076
NPT2468 Cell Line G-361 Homo sapiens IC50 = 58888.45 nM 8021914
NPT2362 Cell Line TYK-nu Homo sapiens IC50 = 459340.61 nM 23062825
NPT399 Cell Line SF-295 Homo sapiens IC50 = 544721.69 nM 21314138
NPT2503 Cell Line NCI-H1703 Homo sapiens IC50 = 164320.04 nM 19943620
NPT2138 Cell Line MSTO-211H Homo sapiens IC50 = 201683.37 nM 8496706
NPT2306 Cell Line Ca-Ski Homo sapiens IC50 = 725600.8 nM 16378364
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens IC50 = 583 nM 20384293
NPT2024 Cell Line NCI-H209 Homo sapiens IC50 = 192583.92 nM 20061160
NPT845 Cell Line BT-474 Homo sapiens IC50 = 1081653.32 nM 18800848
NPT2417 Cell Line UMUC3 Homo sapiens IC50 = 40654.8 nM 18712933
NPT2381 Cell Line SW900 Homo sapiens IC50 = 106553.37 nM 12852747
NPT2066 Cell Line EW-11 Homo sapiens IC50 = 274797.65 nM 16792413
NPT1611 Individual Protein Ribosomal protein S6 kinase 1 Homo sapiens Activity = 103 % PubChem BioAssay data set
NPT2057 Cell Line NCI-H1155 Homo sapiens IC50 = 50348.46 nM 11473426
NPT1957 Cell Line D-502MG Homo sapiens IC50 = 494599.33 nM 23822611
NPT404 Cell Line CCRF-CEM Homo sapiens IC50 = 12668.57 nM 24144848
NPT2 Others Unspecified Activity = 88 % 10514302
NPT2022 Cell Line LS-513 Homo sapiens IC50 = 940678.1 nM 22916954
NPT2426 Cell Line HCC1806 Homo sapiens IC50 = 122446.97 nM 25871261
NPT453 Cell Line HT-1080 Homo sapiens IC50 = 153572.38 nM 25871261
NPT937 Cell Line NCI-H446 Homo sapiens IC50 = 1286400.13 nM PubChem BioAssay data set
NPT2482 Cell Line SW 1116 Homo sapiens IC50 = 446915.26 nM PubChem BioAssay data set
NPT2192 Cell Line HEL Homo sapiens IC50 = 74319.62 nM 21376582
NPT1629 Cell Line CWR22R Homo sapiens IC50 = 608924.33 nM 21616566
NPT2028 Cell Line SK-N-FI Homo sapiens IC50 = 902630.25 nM 15921418
NPT82 Cell Line MDA-MB-231 Homo sapiens IC50 = 654537.58 nM PubChem BioAssay data set
NPT2307 Cell Line 769-P Homo sapiens IC50 = 27783.91 nM 9917297
NPT2470 Cell Line G-402 Homo sapiens IC50 = 422909.83 nM 11754602
NPT2148 Cell Line LB771-HNC Homo sapiens IC50 = 1449621.84 nM 16420055
NPT2106 Cell Line NH-12 Homo sapiens IC50 = 191545.24 nM 10.6019/CHEMBL1201861
NPT2336 Cell Line OE19 Homo sapiens IC50 = 885796.29 nM 10.6019/CHEMBL1201861
NPT2004 Cell Line LS-123 Homo sapiens IC50 = 197260.66 nM 10.6019/CHEMBL1201861
NPT2473 Cell Line MDA-MB-361 Homo sapiens IC50 = 406427.68 nM 10.6019/CHEMBL1201861
NPT1965 Cell Line DEL Homo sapiens IC50 = 62328.7 nM 10.6019/CHEMBL1201861
NPT2209 Cell Line MFH-ino Homo sapiens IC50 = 386457.54 nM 16643036
NPT2008 Cell Line NB69 Homo sapiens IC50 = 167027.76 nM 21839640
NPT2626 Individual Protein Myosin light chain kinase, smooth muscle Homo sapiens Activity = 109 % 21924800
NPT1577 Cell Line SW1573 Homo sapiens IC50 = 1040587.77 nM 11170656
NPT924 Cell Line HSC-2 Homo sapiens IC50 = 313295.55 nM 23067550
NPT2405 Cell Line SAOS-2 Homo sapiens IC50 = 1054945.09 nM 15844934
NPT2361 Cell Line SW780 Homo sapiens IC50 = 630910.49 nM 15043409
NPT1613 Individual Protein Ribosomal protein S6 kinase alpha 5 Homo sapiens Activity = 101 % 15497933
NPT2508 Cell Line SW1710 Homo sapiens IC50 = 170349.63 nM 17253868
NPT114 Cell Line LoVo Homo sapiens IC50 = 150005.36 nM 22932311
NPT2211 Cell Line NB12 Homo sapiens IC50 = 1138693.69 nM 25468043
NPT1956 Cell Line COLO-668 Homo sapiens IC50 = 587180.34 nM 23031596
NPT2117 Cell Line HuTu80 Homo sapiens IC50 = 723598.01 nM 25946116
NPT2273 Cell Line EFO-21 Homo sapiens IC50 = 227569.8 nM 17432904
NPT2515 Cell Line MFE-280 Homo sapiens IC50 = 109007.64 nM 3039137
NPT2414 Cell Line SCC-25 Homo sapiens IC50 = 524391.22 nM 16040241
NPT1953 Cell Line D-336MG Homo sapiens IC50 = 854735.44 nM 17257839
NPT376 Cell Line A498 Homo sapiens IC50 = 601434.72 nM 17420206
NPT1935 Cell Line BB65-RCC Homo sapiens IC50 = 116472.36 nM 17438057
NPT2291 Cell Line CP50-MEL-B Homo sapiens IC50 = 529495.15 nM 18330977
NPT2384 Cell Line HPAF-II Homo sapiens IC50 = 376592.61 nM 18760509
NPT2325 Cell Line BPH-1 Homo sapiens IC50 = 549795.83 nM 17438050
NPT2305 Cell Line CAL-85-1 Homo sapiens IC50 = 310724.29 nM 17470649
NPT1995 Cell Line NB17 Homo sapiens IC50 = 501865.92 nM 17470649
NPT2115 Cell Line HCC2157 Homo sapiens IC50 = 5652.01 nM 17470660
NPT2364 Cell Line GP5d Homo sapiens IC50 = 329881.67 nM 19097894
NPT2456 Cell Line TE-11 Homo sapiens IC50 = 61306.75 nM 18316140
NPT3364 Individual Protein Protein kinase C mu Homo sapiens Activity = 89 % 18070962
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens IC50 = 990 nM 18070972
NPT2012 Cell Line NCI-H720 Homo sapiens IC50 = 68213.4 nM 19540629
NPT2185 Cell Line OCI-AML2 Homo sapiens IC50 = 186839.13 nM 19926364
NPT1932 Cell Line CTV-1 Homo sapiens IC50 = 97507.57 nM 19884366
NPT2048 Cell Line HCC1187 Homo sapiens IC50 = 385688.1 nM 20558071
NPT2475 Cell Line NCI-H1651 Homo sapiens IC50 = 354113.33 nM 18299404
NPT1657 Individual Protein Serine/threonine-protein kinase NEK6 Homo sapiens Activity = 109 % 18955529
NPT1914 Cell Line COLO-824 Homo sapiens IC50 = 153919.85 nM 18838581
NPT110 Individual Protein Cytochrome P450 2D6 Homo sapiens IC50 = 50500 nM 18838581
NPT1987 Cell Line RPMI-8866 Homo sapiens IC50 = 175225.9 nM 18443128
NPT2137 Cell Line MS-1 Homo sapiens IC50 = 16855.67 nM 18936192
NPT1928 Cell Line ATN-1 Homo sapiens IC50 = 185139.02 nM 19188377
NPT1229 Cell Line Huh-7 Homo sapiens IC50 = 1604155.93 nM 19651910
NPT2098 Cell Line EW-18 Homo sapiens IC50 = 196922.65 nM 19721064
NPT1944 Cell Line D-247MG Homo sapiens IC50 = 391018.16 nM 21273067
NPT1998 Cell Line RS4-11 Homo sapiens IC50 = 67472.63 nM 19581457
NPT2444 Cell Line YAPC Homo sapiens IC50 = 602338.15 nM 21524583
NPT1911 Cell Line C2BBe1 Homo sapiens IC50 = 64970.61 nM DrugMatrix in vitro pharmacology data
NPT1959 Cell Line A4-Fuk Homo sapiens IC50 = 170193.16 nM PubChem BioAssay data set
NPT2514 Cell Line LN-405 Homo sapiens IC50 = 66592.77 nM 10.1007/s00044-011-9861-4
NPT2271 Cell Line DoTc2-4510 Homo sapiens IC50 = 163163.86 nM 10.1007/s00044-009-9228-2
NPT728 Individual Protein Serine/threonine-protein kinase AKT Homo sapiens Activity = 89 % 10.1007/s00044-009-9206-8
NPT1971 Cell Line GI-1 Homo sapiens IC50 = 346316.12 nM 10.1007/s00044-012-0437-8
NPT2277 Cell Line C-33-A Homo sapiens IC50 = 455895.67 nM DrugMatrix in vivo data: Pathology
NPT2383 Cell Line ESS-1 Homo sapiens IC50 = 689489.18 nM 10.1039/C1MD00272D
NPT2123 Cell Line MPP-89 Homo sapiens IC50 = 154430.01 nM 25495422
NPT2488 Cell Line MDA-MB-453 Homo sapiens IC50 = 624325.58 nM 10.1039/C4MD00124A
NPT2300 Cell Line CAL-54 Homo sapiens IC50 = 54104.81 nM 26090896
NPT2494 Cell Line RMG-I Homo sapiens IC50 = 221396.01 nM 26497285
NPT2096 Cell Line VA-ES-BJ Homo sapiens IC50 = 206158.03 nM PubChem BioAssay data set
NPT2298 Cell Line BALL-1 Homo sapiens IC50 = 134456.67 nM 15332867
NPT2412 Cell Line Panc1005 Homo sapiens IC50 = 214654.34 nM 21507644
NPT762 Cell Line A-431 Homo sapiens IC50 = 807555.67 nM 19132934
NPT572 Cell Line DMS-273 Homo sapiens IC50 = 225352.54 nM 8133298
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens IC50 = 89 nM 17157006
NPT1948 Cell Line A253 cell line IC50 = 435625.1 nM 9014350
NPT2153 Cell Line RH-1 Homo sapiens IC50 = 314824.08 nM 12088447
NPT2029 Cell Line SW 954 Homo sapiens IC50 = 241567.76 nM 19902967
NPT2154 Cell Line SH-4 Homo sapiens IC50 = 905741.55 nM 19845338
NPT389 Cell Line RPMI-8226 Homo sapiens IC50 = 62224.45 nM 17378609
NPT2480 Cell Line RH-18 Homo sapiens IC50 = 713561.77 nM 17480100
NPT1905 Cell Line ES4 Homo sapiens IC50 = 75947.02 nM 16038541
NPT2366 Cell Line JEG-3 Homo sapiens IC50 = 578482.33 nM 17352491
NPT2003 Cell Line LS-1034 Homo sapiens IC50 = 474850.97 nM 16417306
NPT3207 Individual Protein c-Jun N-terminal kinase 3 Homo sapiens Activity = 98 % 16417306
NPT2330 Cell Line D-566MG Homo sapiens IC50 = 1003338.28 nM 25737008
NPT2074 Cell Line NCI-H1355 Homo sapiens IC50 = 245866.57 nM 23611151
NPT2007 Cell Line NB6 Homo sapiens IC50 = 1292668.54 nM 11908959
NPT2286 Cell Line CAL-120 Homo sapiens IC50 = 185989.09 nM 21377877
NPT2446 Cell Line HCC38 Homo sapiens IC50 = 517753.37 nM 9514009
NPT2314 Cell Line BEN Homo sapiens IC50 = 314946.88 nM 1919592
NPT3284 Individual Protein Serine/threonine-protein kinase NEK7 Homo sapiens Activity = 105 % 11858759
NPT2177 Cell Line HDLM-2 Homo sapiens IC50 = 105362.21 nM 20627740
NPT2308 Cell Line CAMA-1 Homo sapiens IC50 = 293060.48 nM 20627740
NPT1091 Cell Line RPMI-7951 Homo sapiens IC50 = 246729.11 nM 10.1584/jpestics.27.127
NPT2452 Cell Line NCI-H292 IC50 = 70866.87 nM 23543830
NPT1383 Cell Line A2058 Homo sapiens IC50 = 724808.88 nM PubChem BioAssay data set
NPT1954 Cell Line D-392MG Homo sapiens IC50 = 176314.44 nM PubChem BioAssay data set
NPT2334 Cell Line NCI-H1793 Homo sapiens IC50 = 308606.19 nM 12027733
NPT2303 Cell Line 647-V Homo sapiens IC50 = 1013659.17 nM 20541427
NPT1969 Cell Line TGW Homo sapiens IC50 = 86031.71 nM 19902967
NPT2511 Cell Line HGC-27 Homo sapiens IC50 = 224554.63 nM 19902967
NPT1700 Individual Protein Serine/threonine-protein kinase PIM2 Homo sapiens Activity = 95 % 19921834
NPT1912 Cell Line COLO-800 Homo sapiens IC50 = 1177622.67 nM 10924160
NPT1976 Cell Line LNCaP-Clone-FGC Homo sapiens IC50 = 1131743.9 nM 21130542
NPT1614 Individual Protein MAP kinase p38 delta Homo sapiens Activity = 88 % 15497961
NPT1952 Cell Line COLO-320-HSR Homo sapiens IC50 = 102376.58 nM 23434030
NPT401 Cell Line 786-0 Homo sapiens IC50 = 260540.68 nM 23434030
NPT2350 Cell Line HN Homo sapiens IC50 = 68561.49 nM 23434131
NPT2174 Cell Line TE-8 Homo sapiens IC50 = 561991.65 nM 16722644
NPT2152 Cell Line NTERA-2-cl-D1 Homo sapiens IC50 = 57031.69 nM PubChem BioAssay data set
NPT2421 Cell Line PFSK-1 Homo sapiens IC50 = 1279130.72 nM 19095451
NPT1963 Cell Line Becker Homo sapiens IC50 = 85180.71 nM 16643022
NPT1820 Cell Line NCI-H1650 Homo sapiens IC50 = 222592.11 nM 25136911
NPT2121 Cell Line LB2241-RCC Homo sapiens IC50 = 73863.96 nM 11741487
NPT2373 Cell Line KYSE-150 cell line IC50 = 1267132.81 nM 10.6019/CHEMBL1201861
NPT2135 Cell Line LB373-MEL-D Homo sapiens IC50 = 382452.32 nM 10.6019/CHEMBL1201861
NPT2466 Cell Line NCI-H358 Homo sapiens IC50 = 194425.88 nM 10.6019/CHEMBL1201861
NPT2140 Cell Line NOMO-1 Homo sapiens IC50 = 178758.55 nM 10.6019/CHEMBL1201861
NPT2380 Cell Line SK-N-AS Homo sapiens IC50 = 134604.25 nM 16933872
NPT2422 Cell Line SCC-4 Homo sapiens IC50 = 96129.86 nM 24645629
NPT3113 Individual Protein Tyrosine-protein kinase CSK Homo sapiens Activity = 105 % 26034885
NPT576 Cell Line DMS-114 Homo sapiens IC50 = 516803.13 nM 26034885
NPT2425 Cell Line UMC-11 Homo sapiens IC50 = 407590.5 nM 11141110
NPT1955 Cell Line A3-KAW Homo sapiens IC50 = 172678.24 nM 12608849
NPT2455 Cell Line SNU-C2B Homo sapiens IC50 = 314982.47 nM 20102170
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens IC50 = 370 nM 10514334
NPT170 Cell Line SK-MEL-28 Homo sapiens IC50 = 252487.57 nM 10514334
NPT3280 Individual Protein Serine/threonine-protein kinase c-TAK1 Homo sapiens Activity = 113 % 17844994
NPT2390 Cell Line NCI-H2122 Homo sapiens IC50 = 258358.72 nM 25739048
NPT2293 Cell Line CAL-39 Homo sapiens IC50 = 952998.19 nM 24901800
NPT926 Cell Line SK-MEL-1 Homo sapiens IC50 = 9049.28 nM 19555123
NPT392 Cell Line SNB-75 Homo sapiens IC50 = 302444.87 nM 12662106
NPT2437 Cell Line EW-22 Homo sapiens IC50 = 445556.47 nM PubChem BioAssay data set
NPT1903 Cell Line ES5 Homo sapiens IC50 = 399954.98 nM 25951057
NPT2165 Cell Line KNS-42 Homo sapiens IC50 = 316685.45 nM 25237727
NPT1972 Cell Line GI-ME-N Homo sapiens IC50 = 1123589.78 nM 26341134
NPT2202 Cell Line TGBC1TKB Homo sapiens IC50 = 426683.28 nM PubChem BioAssay data set
NPT387 Cell Line M14 Homo sapiens IC50 = 476727.95 nM 10395485
NPT2385 Cell Line HSC-3 Homo sapiens IC50 = 27013.86 nM 8389875
NPT6632 Cell Line CHP-134 Homo sapiens IC50 = 11563.46 nM 17493824
NPT1919 Cell Line DOHH-2 Homo sapiens IC50 = 103678.84 nM 17188868
NPT2404 Cell Line SW982 Homo sapiens IC50 = 364662.77 nM 20739103
NPT2144 Cell Line TE-12 Homo sapiens IC50 = 76374.05 nM 21419530
NPT1997 Cell Line OS-RC-2 Homo sapiens IC50 = 45856.23 nM 21733601
NPT1696 Individual Protein Serine/threonine-protein kinase PAK7 Homo sapiens Activity = 86 % DrugMatrix in vitro pharmacology data
NPT2348 Cell Line HLE Homo sapiens IC50 = 693194.07 nM DrugMatrix in vitro pharmacology data
NPT2197 Cell Line NCI-H1770 Homo sapiens IC50 = 173036.92 nM DrugMatrix in vitro pharmacology data
NPT2406 Cell Line HCC1395 Homo sapiens IC50 = 1311685.2 nM DrugMatrix in vitro pharmacology data
NPT2479 Cell Line OAW-28 Homo sapiens IC50 = 133537.32 nM 22104973
NPT1989 Cell Line GOTO Homo sapiens IC50 = 303500.73 nM 22704923
NPT379 Cell Line HOP-62 Homo sapiens IC50 = 461179.34 nM 10.6019/CHEMBL1201861
NPT2374 Cell Line KYSE-180 Homo sapiens IC50 = 94839.12 nM 10.6019/CHEMBL1201861
NPT890 Cell Line SNU-387 Homo sapiens IC50 = 989827.81 nM 10.6019/CHEMBL1201861
NPT1916 Cell Line ACN Homo sapiens IC50 = 550946.11 nM 10.6019/CHEMBL1201861
NPT377 Cell Line OVCAR-3 Homo sapiens IC50 = 63864.97 nM 10.6019/CHEMBL1201861
NPT2333 Cell Line DBTRG-05MG Homo sapiens IC50 = 21709.02 nM 10.6019/CHEMBL1201861
NPT2276 Cell Line A673 Homo sapiens IC50 = 300449.59 nM Open TG-GATES in vivo data: Hematology
NPT2428 Cell Line HT-3 Homo sapiens IC50 = 862211.84 nM Open TG-GATES in vivo data: Hematology
NPT2354 Cell Line NCI-H2009 Homo sapiens IC50 = 786384.61 nM Open TG-GATES in vivo data: Hematology
NPT2489 Cell Line MeWo Homo sapiens IC50 = 409009.34 nM Open TG-GATES in vivo data: Biochemistry
NPT3455 Individual Protein Protein kinase C zeta Homo sapiens Activity = 82 % Open TG-GATES in vivo data: Biochemistry
NPT2498 Cell Line KOSC-2 Homo sapiens IC50 = 226691.49 nM Open TG-GATES in vivo data: Biochemistry
NPT1680 Individual Protein Serine/threonine-protein kinase Chk2 Homo sapiens Activity = 99 % Open TG-GATES in vivo data: Biochemistry
NPT2114 Cell Line EW-3 Homo sapiens IC50 = 18313.45 nM Open TG-GATES in vivo data: Organ Weight
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens IC50 = 20600 nM 15646539
NPT2159 Cell Line TE-5 Homo sapiens IC50 = 745204 nM 25062006
NPT2344 Cell Line SK-MEL-24 Homo sapiens IC50 = 39224.2 nM 24937209
NPT405 Cell Line NCI-H226 Homo sapiens IC50 = 725644.34 nM 26010585
NPT1892 Cell Line H4 Rattus norvegicus IC50 = 527523.28 nM 26160020
NPT2436 Cell Line VMRC-RCZ Homo sapiens IC50 = 402636.03 nM 26988298
NPT2457 Cell Line YKG-1 Homo sapiens IC50 = 38257.59 nM 22694318
NPT2339 Cell Line TGBC24TKB Homo sapiens IC50 = 960753.62 nM 17190463
NPT2485 Cell Line IA-LM Homo sapiens IC50 = 266150.25 nM PubChem BioAssay data set
NPT658 Cell Line HT1197 Homo sapiens IC50 = 166603.21 nM 19441852
NPT2317 Cell Line ChaGo-K-1 Homo sapiens IC50 = 195428.97 nM 24689881
NPT2278 Cell Line COLO-741 Homo sapiens IC50 = 513157.59 nM 24689881
NPT1695 Individual Protein Serine/threonine-protein kinase PAK 4 Homo sapiens Activity = 95 % 8105084
NPT2505 Cell Line NCI-H520 IC50 = 534627.9 nM 20570145
NPT1396 Cell Line NCI-H69 Homo sapiens IC50 = 258763.11 nM 26034885
NPT2122 Cell Line MC116 Homo sapiens IC50 = 174102.99 nM 14510611
NPT1649 Cell Line MV4-11 Homo sapiens IC50 = 11730.9 nM 14664515
NPT3815 Individual Protein Tyrosine-protein kinase LCK Mus musculus Activity = 88 % 14640510
NPT2086 Cell Line L-428 Homo sapiens IC50 = 91760.51 nM 18314943
NPT2410 Cell Line NCI-H1299 Homo sapiens IC50 = 55347.14 nM PubChem BioAssay data set
NPT1678 Individual Protein CaM-kinase kinase beta Homo sapiens Activity = 108 % 23398362
NPT2493 Cell Line OC-314 Homo sapiens IC50 = 1643979.33 nM 9548875
NPT1705 Individual Protein Ribosomal protein S6 kinase alpha 3 Homo sapiens Activity = 30 % 20634081
NPT1697 Individual Protein Serine/threonine-protein kinase PAK6 Homo sapiens Activity = 127 % 20624681
NPT2272 Cell Line EFM-19 Homo sapiens IC50 = 433724.7 nM 23819826
NPT2017 Cell Line ES7 Homo sapiens IC50 = 453186.62 nM 20035556
NPT307 Cell Line HOS Homo sapiens IC50 = 316226.27 nM 20192247
NPT2049 Cell Line HT Homo sapiens IC50 = 803498.24 nM 16448174
NPT2447 Cell Line HuCCT-1 Homo sapiens IC50 = 504047.75 nM 16448174
NPT2072 Cell Line MN-60 Homo sapiens IC50 = 18099.35 nM 16448174
NPT2015 Cell Line U-266 Homo sapiens IC50 = 312854.43 nM 19948405
NPT2507 Cell Line RPMI-2650 Homo sapiens IC50 = 282787.01 nM 8786361
NPT2460 Cell Line HCE-4 Homo sapiens IC50 = 85569.17 nM 2895165
NPT1996 Cell Line NB5 Homo sapiens IC50 = 430662.62 nM 17844994
NPT2020 Cell Line JVM-3 Homo sapiens IC50 = 250702.26 nM 17844994
NPT1946 Cell Line D-263MG Homo sapiens IC50 = 435167.93 nM 17480098
NPT2487 Cell Line KNS-62 Homo sapiens IC50 = 113873.82 nM 11908979
NPT2440 Cell Line NCI-H1563 Homo sapiens IC50 = 890236.36 nM 19072209
NPT2363 Cell Line U-118-MG Homo sapiens IC50 = 289593.73 nM 15332848
NPT2274 Cell Line EFO-27 Homo sapiens IC50 = 377591.91 nM 11975490
NPT3248 Individual Protein CaM-kinase kinase alpha Homo sapiens Activity = 116 % 26900954
NPT2120 Cell Line LB1047-RCC Homo sapiens IC50 = 676492.26 nM 9871531
NPT1984 Cell Line ONS-76 Homo sapiens IC50 = 977862.43 nM PubChem BioAssay data set
NPT2168 Cell Line MZ2-MEL Homo sapiens IC50 = 189229.96 nM 15787442
NPT2375 Cell Line MKN-1 Homo sapiens IC50 = 247337.8 nM 24571273
NPT2413 Cell Line PC-14 Homo sapiens IC50 = 815242 nM 24571273
NPT1940 Cell Line BE-13 Homo sapiens IC50 = 142444.15 nM 17609121
NPT2027 Cell Line SK-N-DZ Homo sapiens IC50 = 11704.5 nM PubChem BioAssay data set
NPT2056 Cell Line MLMA Homo sapiens IC50 = 166093.35 nM 12139460
NPT759 Cell Line H9 Homo sapiens IC50 = 22289.26 nM 17064070
NPT2398 Cell Line MKN-7 Homo sapiens IC50 = 806773.53 nM 17242150
NPT2346 Cell Line TI-73 Homo sapiens IC50 = 456497.4 nM 19231182
NPT1703 Individual Protein cAMP-dependent protein kinase alpha-catalytic subunit Homo sapiens Activity = 92 % 14510589
NPT2313 Cell Line BCPAP Homo sapiens IC50 = 406137.19 nM 12828469
NPT369 Cell Line ACHN Homo sapiens IC50 = 161338.56 nM 8450319
NPT2084 Cell Line KARPAS-45 Homo sapiens IC50 = 33493.52 nM 19196516
NPT2170 Cell Line RKO Homo sapiens IC50 = 62951.34 nM 17967917
NPT2169 Cell Line MZ7-mel Homo sapiens IC50 = 477927 nM 19703776
NPT2005 Cell Line MHH-NB-11 Homo sapiens IC50 = 863537.22 nM 20361799
NPT368 Cell Line SN12C Homo sapiens IC50 = 177750.17 nM 20361799
NPT1184 Cell Line Daoy Homo sapiens IC50 = 19393.91 nM 20709557
NPT1699 Individual Protein 3-phosphoinositide dependent protein kinase-1 Homo sapiens Activity = 103 % 19651905
NPT2495 Cell Line SW1417 Homo sapiens IC50 = 474085.18 nM 21910466
NPT2359 Cell Line SK-MEL-30 Homo sapiens IC50 = 14642.82 nM 22269277
NPT2449 Cell Line NCI-H1573 Homo sapiens IC50 = 72737.86 nM 22464685
NPT2342 Cell Line NCI-H630 Homo sapiens IC50 = 867571.56 nM 21852132
NPT2343 Cell Line NCI-H650 Homo sapiens IC50 = 273680.13 nM 22683112
NPT831 Individual Protein Serine/threonine-protein kinase PLK1 Homo sapiens Activity = 112 % 22783984
NPT2391 Cell Line NCI-H810 Homo sapiens IC50 = 643948.01 nM 23270565
NPT2431 Cell Line NCI-H1437 Homo sapiens IC50 = 162815.39 nM 23896611
NPT2454 Cell Line RD Homo sapiens IC50 = 78834.05 nM 24468411
NPT2101 Cell Line LAN-6 Homo sapiens IC50 = 542288.96 nM 10.1039/C1MD00127B
NPT2477 Cell Line NUGC-3 Homo sapiens IC50 = 178481.51 nM 24568587
NPT2166 Cell Line LB831-BLC Homo sapiens IC50 = 508206.06 nM 137981
NPT179 Cell Line A2780 Homo sapiens IC50 = 265182.43 nM 24906512
NPT2181 Cell Line MEG-01 Homo sapiens IC50 = 265346.1 nM 25137549
NPT2438 Cell Line HTC-C3 Homo sapiens IC50 = 21602.09 nM 25137549
NPT2411 Cell Line NCI-H2228 Homo sapiens IC50 = 166076.58 nM 25593097
NPT2358 Cell Line SK-MEL3 Homo sapiens IC50 = 7738.35 nM 25835647
NPT2321 Cell Line BHT-101 Homo sapiens IC50 = 428791.59 nM 15387651
NPT1701 Individual Protein Serine/threonine-protein kinase PIM3 Homo sapiens Activity = 49 % 23398362
NPT2415 Cell Line SKG-IIIa Homo sapiens IC50 = 978838.83 nM 23398362
NPT2299 Cell Line CAL-51 Homo sapiens IC50 = 64735.13 nM 23398362
NPT1535 Cell Line U-87 MG Homo sapiens IC50 = 302126.56 nM 10.1039/C2MD20076G
NPT2472 Cell Line HuP-T4 Homo sapiens IC50 = 953470.04 nM 11374943
NPT2 Others Unspecified Activity = 55.4 % 15497938
NPT2206 Cell Line IST-MES1 Homo sapiens IC50 = 25601.58 nM 14640569
NPT2043 Cell Line SK-NEP-1 Homo sapiens IC50 = 23896.88 nM 23571415
NPT1941 Cell Line A101D Homo sapiens IC50 = 116831.65 nM 17848089
NPT2400 Cell Line PA-1 Homo sapiens IC50 = 500153.47 nM 12639542
NPT3232 Individual Protein CaM kinase I alpha Homo sapiens Activity = 105 % 11000036
NPT371 Cell Line UO-31 Homo sapiens IC50 = 232827.31 nM 24697496
NPT2331 Cell Line A-427 Homo sapiens IC50 = 678881.78 nM 11975502
NPT2432 Cell Line NCI-H2342 Homo sapiens IC50 = 1154755.6 nM 10869203
NPT2351 Cell Line MG-63 Homo sapiens IC50 = 479314.52 nM 10869203
NPT3266 Individual Protein Casein kinase I delta Homo sapiens Activity = 88 % 10869203
NPT1216 Cell Line FaDu Homo sapiens IC50 = 48827.42 nM 19835393
NPT3106 Individual Protein Ribosomal protein S6 kinase alpha 1 Homo sapiens Activity = 23 % 23734701
NPT403 Cell Line UACC-257 Homo sapiens IC50 = 223369.42 nM 20666364
NPT2337 Cell Line OE33 Homo sapiens IC50 = 56086.49 nM 24180210
NPT2496 Cell Line SW1463 Homo sapiens IC50 = 95289.92 nM 24044895
NPT2173 Cell Line TE-6 Homo sapiens IC50 = 1007659.91 nM 24645629
NPT2281 Cell Line ABC-1 Homo sapiens IC50 = 483529.83 nM 15217281
NPT2378 Cell Line NCI-H727 Homo sapiens IC50 = 120296.92 nM 23354070
NPT2335 Cell Line NCI-H596 IC50 = 626116.21 nM 25245917
NPT83 Cell Line MCF7 Homo sapiens Inhibition = 60 % 10843570
NPT1943 Cell Line CGTH-W-1 Homo sapiens IC50 = 336274.91 nM 22901896
NPT2025 Cell Line NCI-H747 Homo sapiens IC50 = 451164.04 nM 25856683
NPT465 Cell Line NCI-N87 Homo sapiens IC50 = 612240.39 nM 21288727
NPT2382 Cell Line SW948 Homo sapiens IC50 = 350437.02 nM 25819096
NPT2372 Cell Line H-EMC-SS Homo sapiens IC50 = 999391.91 nM 20303767
NPT3283 Individual Protein MAP kinase-interacting serine/threonine-protein kinase MNK1 Homo sapiens Activity = 82 % 8133298
NPT2418 Cell Line HCC1569 Homo sapiens IC50 = 570582.63 nM 18640837
NPT2288 Cell Line AN3-CA Homo sapiens IC50 = 248568.63 nM 10479316
NPT1045 Cell Line U2OS Homo sapiens IC50 = 193121.78 nM 26358281
NPT397 Cell Line NCI-H460 Homo sapiens IC50 = 97977.61 nM 26358281
NPT2080 Cell Line EW-13 Homo sapiens IC50 = 11381.42 nM 21643465
NPT2481 Cell Line SW1088 Homo sapiens IC50 = 236698.22 nM 22137934
NPT1313 Cell Line Capan-2 Homo sapiens IC50 = 188316.87 nM 12662097
NPT2486 Cell Line IGR-1 Homo sapiens IC50 = 936890.11 nM 23145909
NPT1975 Cell Line KS-1 Homo sapiens IC50 = 540099.29 nM 15730238
NPT3465 Cell Line ECC10 Homo sapiens IC50 = 52380.38 nM 22445674
NPT2284 Cell Line C3A Homo sapiens IC50 = 223539.92 nM 9584401
NPT2297 Cell Line ASPC1 Homo sapiens IC50 = 79545.09 nM 16309305
NPT1988 Cell Line SW684 Homo sapiens IC50 = 575662.18 nM 23691978
NPT1179 Cell Line MKN-28 Homo sapiens IC50 = 73749.78 nM 14738391
NPT370 Cell Line NCI-H23 Homo sapiens IC50 = 166157.48 nM 17353252
NPT2430 Cell Line M059J Homo sapiens IC50 = 725066.23 nM 19012394
NPT2442 Cell Line NCI-H2405 Homo sapiens IC50 = 416498.97 nM 20373816
NPT2510 Cell Line GCT Homo sapiens IC50 = 316080.84 nM 19805565
NPT2039 Cell Line NCI-H82 Homo sapiens IC50 = 5062.16 nM 19805554
NPT2070 Cell Line LXF-289 cell line IC50 = 321011.2 nM 19933793
NPT2320 Cell Line BFTC-909 Homo sapiens IC50 = 44913.26 nM 20038618
NPT2128 Cell Line RCC10RGB Homo sapiens IC50 = 398363.94 nM 18180356
NPT111 Cell Line K562 Homo sapiens IC50 = 183721.13 nM 18644958
NPT2006 Cell Line MHH-PREB-1 Homo sapiens IC50 = 62853.15 nM 18710917
NPT2360 Cell Line SW756 Homo sapiens IC50 = 966662.1 nM 18725441
NPT2199 Cell Line OCUB-M Homo sapiens IC50 = 38077.55 nM 18285482
NPT282 Individual Protein MAP kinase ERK2 Homo sapiens Activity = 98 % 18519722
NPT283 Individual Protein MAP kinase p38 alpha Homo sapiens Activity = 94 % 20970332
NPT1094 Cell Line 697 Homo sapiens IC50 = 52497.47 nM 19349512
NPT2471 Cell Line HuP-T3 Homo sapiens IC50 = 81189.99 nM 19349512
NPT1505 Cell Line J82 Homo sapiens IC50 = 253247.94 nM 19258280
NPT1930 Cell Line CTB-1 Homo sapiens IC50 = 7321.56 nM 20231393
NPT2139 Cell Line NCI-H1581 Homo sapiens IC50 = 113271.21 nM 20805391
NPT374 Cell Line SF-539 Homo sapiens IC50 = 684698.09 nM DrugMatrix in vitro pharmacology data
NPT1615 Individual Protein MAP kinase p38 gamma Homo sapiens Activity = 103 % 23352268
NPT2044 Cell Line SW 962 Homo sapiens IC50 = 172234 nM DrugMatrix in vivo data: Biochemistry
NPT2513 Cell Line LK-2 Homo sapiens IC50 = 223963.7 nM DrugMatrix in vivo data: Hematology
NPT2089 Cell Line NCI-H1395 Homo sapiens IC50 = 218680.12 nM 24927053
NPT2292 Cell Line CAL-33 Homo sapiens IC50 = 471075.79 nM 26476666
NPT1884 Cell Line HCC1937 Homo sapiens IC50 = 606711.87 nM 23268694
NPT1934 Cell Line BB49-HNC Homo sapiens IC50 = 239765.17 nM 26295746
NPT2332 Cell Line COLO-680N Homo sapiens IC50 = 80186.49 nM 19228038
NPT2478 Cell Line NY Homo sapiens IC50 = 14997.01 nM 25510639
NPT2347 Cell Line GMS-10 Homo sapiens IC50 = 508422.1 nM PubChem BioAssay data set
NPT2500 Cell Line LCLC-103H cell line IC50 = 344166.31 nM 12762791
NPT2067 Cell Line KARPAS-299 Homo sapiens IC50 = 14994.97 nM 25397992
NPT2112 Cell Line TE-1 Homo sapiens IC50 = 359447.09 nM 25397992
NPT2295 Cell Line 5637 Homo sapiens IC50 = 569710.31 nM 20055495
NPT2502 Cell Line MEL-JUSO Homo sapiens IC50 = 132028.13 nM 21875800
NPT783 Cell Line MIA PaCa-2 Homo sapiens IC50 = 104606.85 nM 23587837
NPT2371 Cell Line SW837 Homo sapiens IC50 = 174687.91 nM 23587837
NPT2393 Cell Line SAS Homo sapiens IC50 = 245592.58 nM 17524651
NPT1947 Cell Line D283 Med IC50 = 388404.37 nM 19007286
NPT1901 Cell Line EM-2 Homo sapiens IC50 = 12796.25 nM 25946116
NPT2019 Cell Line JVM-2 Homo sapiens IC50 = 403413.46 nM 25946116
NPT3114 Individual Protein Dual-specificity tyrosine-phosphorylation regulated kinase 1A Homo sapiens Activity = 80 % 25946116
NPT1899 Cell Line DSH1 Homo sapiens IC50 = 250828.64 nM PubChem BioAssay data set
NPT2409 Cell Line LU-99A Homo sapiens IC50 = 124848.62 nM 19256529
NPT2109 Cell Line SCH Homo sapiens IC50 = 1063683.33 nM 17190465
NPT2134 Cell Line LB2518-MEL Homo sapiens IC50 = 559182.56 nM DrugMatrix in vitro pharmacology data
NPT2092 Cell Line NEC8 Homo sapiens IC50 = 254274.65 nM DrugMatrix in vitro pharmacology data
NPT393 Cell Line HCT-116 Homo sapiens IC50 = 161758.91 nM 11430019
NPT396 Cell Line T47D Homo sapiens IC50 = 315574.25 nM 2362268
NPT2324 Cell Line CHP-212 Homo sapiens IC50 = 663168.43 nM PubChem BioAssay data set
NPT2208 Cell Line KP-N-YS Homo sapiens IC50 = 82277.11 nM DrugMatrix in vitro pharmacology data
NPT2026 Cell Line Ramos-2G6-4C10 Homo sapiens IC50 = 228893.54 nM PubChem BioAssay data set
NPT2423 Cell Line SCC-9 Homo sapiens IC50 = 776950 nM PubChem BioAssay data set
NPT3432 Individual Protein Homeodomain-interacting protein kinase 2 Homo sapiens Activity = 72 % DrugMatrix in vivo data: Biochemistry
NPT2270 Cell Line Detroit562 Homo sapiens IC50 = 318920.87 nM 24387683
NPT2367 Cell Line KYSE-140 Homo sapiens IC50 = 443549.76 nM 17118653
NPT81 Cell Line A549 Homo sapiens IC50 = 572066.93 nM 23145909
NPT2018 Cell Line GT3TKB Homo sapiens IC50 = 421705.41 nM 16441070
NPT2370 Cell Line RVH-421 Homo sapiens IC50 = 973677.36 nM 16038541
NPT2329 Cell Line COLO-679 Homo sapiens IC50 = 1230318.06 nM 18847278
NPT2484 Cell Line GAMG Homo sapiens IC50 = 186804.95 nM 9917292
NPT2448 Cell Line KLE Homo sapiens IC50 = 894808.74 nM DrugMatrix in vitro pharmacology data
NPT2357 Cell Line RT-112 Homo sapiens IC50 = 92343.75 nM 19674906
NPT1609 Protein Complex Casein kinase II Homo sapiens Activity = 101 % 11374948
NPT1966 Cell Line NCI-H1838 Homo sapiens IC50 = 261808.68 nM 15711537
NPT2323 Cell Line BHY Homo sapiens IC50 = 55688.74 nM 15711537
NPT2032 Cell Line HAL-01 Homo sapiens IC50 = 145918.32 nM 18077425
NPT2408 Cell Line KYSE-70 cell line IC50 = 287628.87 nM 18077425
NPT2395 Cell Line KYSE-450 Homo sapiens IC50 = 131892.47 nM 18077425
NPT3461 Individual Protein MAP kinase-activated protein kinase 3 Homo sapiens Activity = 112 % 18183025
NPT2499 Cell Line KP-4 Homo sapiens IC50 = 158545.4 nM 19654408
NPT3357 Individual Protein Protein kinase N2 Homo sapiens Activity = 107 % 21450463
NPT2269 Cell Line EPLC-272H Homo sapiens IC50 = 35749.17 nM 22037378
NPT1964 Cell Line COLO-684 Homo sapiens IC50 = 26150.6 nM 22037378
NPT2053 Cell Line LU-139 Homo sapiens IC50 = 62856.42 nM 22037378
NPT2461 Cell Line HuO-3N1 Homo sapiens IC50 = 2775.01 nM 22560627
NPT2327 Cell Line D-423MG Homo sapiens IC50 = 188858.49 nM PubChem BioAssay data set
NPT90 Cell Line DU-145 Homo sapiens IC50 = 100272.35 nM 24960143
NPT2052 Cell Line KALS-1 Homo sapiens IC50 = 121989.62 nM 8759172
NPT386 Cell Line KM12 Homo sapiens IC50 = 316355.95 nM 23434636
NPT3814 Protein Complex Cyclin-dependent kinase 2/cyclin A Homo sapiens Activity = 106 % 20155971
NPT2036 Cell Line NCI-H1092 Homo sapiens IC50 = 73547.83 nM 14640511
NPT2002 Cell Line KY821 Homo sapiens IC50 = 35102.38 nM 21970540
NPT2073 Cell Line NCI-H1304 Homo sapiens IC50 = 25059.35 nM 25856683
NPT2167 Cell Line LB996-RCC Homo sapiens IC50 = 74425.16 nM 8463795
NPT182 Individual Protein Protein kinase C alpha Homo sapiens Activity = 90 % 19702283
NPT1961 Cell Line D-542MG Homo sapiens IC50 = 338840.33 nM 1895288
NPT456 Cell Line OVCAR-4 Homo sapiens IC50 = 531472.79 nM 16472241
NPT1937 Cell Line CAS-1 Homo sapiens IC50 = 1097655.7 nM 16472241
NPT2491 Cell Line NCI-H1693 Homo sapiens IC50 = 296645.26 nM DrugMatrix in vitro pharmacology data
NPT2312 Cell Line 8305C Homo sapiens IC50 = 624848.99 nM DrugMatrix in vitro pharmacology data
NPT1448 Individual Protein Serine/threonine-protein kinase Sgk1 Homo sapiens Activity = 110 % 15646539
NPT2376 Cell Line NBsusSR Homo sapiens IC50 = 13316.91 nM 10.6019/CHEMBL3301361
NPT2435 Cell Line VM-CUB-1 Homo sapiens IC50 = 28192.73 nM 24679044
NPT1931 Cell Line BB30-HNC Homo sapiens IC50 = 832808.73 nM 18665642
NPT981 Individual Protein Inhibitor of nuclear factor kappa B kinase beta subunit Homo sapiens Activity = 100 % 15482904
NPT2402 Cell Line PANC-08-13 Homo sapiens IC50 = 138355.44 nM PubChem BioAssay data set
NPT2127 Cell Line NMC-G1 Homo sapiens IC50 = 238962.11 nM 8064806
NPT2439 Cell Line MC-IXC Homo sapiens IC50 = 805206.69 nM 18417256
NPT2453 Cell Line RCM-1 Homo sapiens IC50 = 770675.19 nM 17938184
NPT1980 Cell Line NB14 Homo sapiens IC50 = 149546.14 nM 20038624
NPT2280 Cell Line A704 Homo sapiens IC50 = 1822351.54 nM 18694945
NPT2 Others Unspecified Activity = 97 % 19596880
NPT2141 Cell Line NOS-1 Homo sapiens IC50 = 463979.33 nM DrugMatrix in vitro pharmacology data
NPT491 Individual Protein Dual specificity mitogen-activated protein kinase kinase 1 Homo sapiens Activity = 88 % 22194678
NPT2063 Cell Line SK-PN-DW Homo sapiens IC50 = 20564.12 nM 22995771
NPT1616 Individual Protein MAP kinase p38 beta Homo sapiens Activity = 98 % 10.1007/s00044-011-9918-4
NPT3466 Cell Line MOLT-13 Homo sapiens IC50 = 200745.91 nM 23811259
NPT2204 Cell Line HH Homo sapiens IC50 = 73572.7 nM DrugMatrix in vivo data: Pathology
NPT2309 Cell Line CAPAN-1 Homo sapiens IC50 = 50292.4 nM 23992864
NPT2315 Cell Line BFTC-905 Homo sapiens IC50 = 52498.73 nM 12088429
NPT2290 Cell Line CAL-27 Homo sapiens IC50 = 142027.54 nM 18327911
NPT406 Cell Line RXF 393 Homo sapiens IC50 = 98854.1 nM 20655237
NPT380 Cell Line U-251 Homo sapiens IC50 = 26766.12 nM 3572419
NPT1978 Cell Line MFM-223 Homo sapiens IC50 = 340178.34 nM 17296744
NPT116 Cell Line HL-60 Homo sapiens IC50 = 177636.8 nM 19721074
NPT2097 Cell Line EW-16 Homo sapiens IC50 = 296048.12 nM 19721074
NPT1215 Cell Line 8505C Homo sapiens IC50 = 883379.59 nM 22194678
NPT2282 Cell Line C32 Homo sapiens IC50 = 17660.56 nM 22459876
NPT1612 Individual Protein MAP kinase-activated protein kinase 5 Homo sapiens Activity = 82 % 23811085
NPT1992 Cell Line KURAMOCHI Homo sapiens IC50 = 1122672.18 nM 23811085
NPT1097 Cell Line MKN-45 Homo sapiens IC50 = 926994.84 nM 24262883
NPT2301 Cell Line CAL-62 Homo sapiens IC50 = 150508.11 nM 26213786
NPT2289 Cell Line CAL-12T Homo sapiens IC50 = 496486.35 nM 21332115
NPT382 Cell Line OVCAR-5 Homo sapiens IC50 = 1529551.75 nM PubChem BioAssay data set
NPT2399 Cell Line NCI-H2170 Homo sapiens IC50 = 224405.12 nM 15165138
NPT3331 Individual Protein Serine/threonine-protein kinase MST2 Homo sapiens Activity = 99 % 15165138
NPT2355 Cell Line NCI-H2029 Homo sapiens IC50 = 269332.32 nM 23999046
NPT2287 Cell Line COR-L23 Homo sapiens IC50 = 59533.43 nM 21741249

  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 NPC85707 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
1.0 High Similarity NPC48093
1.0 High Similarity NPC224530
1.0 High Similarity NPC259957
1.0 High Similarity NPC129217
1.0 High Similarity NPC216496
1.0 High Similarity NPC159579
0.9935 High Similarity NPC27942
0.987 High Similarity NPC121703
0.9869 High Similarity NPC282169
0.9868 High Similarity NPC41121
0.9868 High Similarity NPC320283
0.9868 High Similarity NPC104677
0.9868 High Similarity NPC472459
0.9868 High Similarity NPC111929
0.9806 High Similarity NPC72016
0.9803 High Similarity NPC135391
0.9803 High Similarity NPC182634
0.9803 High Similarity NPC77672
0.9803 High Similarity NPC78263
0.9803 High Similarity NPC133671
0.9803 High Similarity NPC54802
0.9803 High Similarity NPC197304
0.9803 High Similarity NPC108831
0.9744 High Similarity NPC64425
0.974 High Similarity NPC249281
0.974 High Similarity NPC473438
0.974 High Similarity NPC163242
0.974 High Similarity NPC276377
0.974 High Similarity NPC173582
0.974 High Similarity NPC253788
0.974 High Similarity NPC265885
0.974 High Similarity NPC116458
0.974 High Similarity NPC476215
0.974 High Similarity NPC246943
0.974 High Similarity NPC215710
0.974 High Similarity NPC139320
0.974 High Similarity NPC181465
0.9737 High Similarity NPC323593
0.9737 High Similarity NPC203500
0.9737 High Similarity NPC307938
0.9679 High Similarity NPC139060
0.9679 High Similarity NPC205824
0.9679 High Similarity NPC19240
0.9679 High Similarity NPC129264
0.9679 High Similarity NPC85751
0.9677 High Similarity NPC150164
0.9677 High Similarity NPC240306
0.9675 High Similarity NPC471079
0.9675 High Similarity NPC304741
0.9675 High Similarity NPC153342
0.9675 High Similarity NPC470405
0.9675 High Similarity NPC187379
0.9671 High Similarity NPC27408
0.9671 High Similarity NPC95090
0.9615 High Similarity NPC66087
0.9615 High Similarity NPC80068
0.9615 High Similarity NPC278419
0.9615 High Similarity NPC179198
0.9613 High Similarity NPC297987
0.9613 High Similarity NPC135846
0.9613 High Similarity NPC101636
0.9613 High Similarity NPC470125
0.9613 High Similarity NPC64305
0.9613 High Similarity NPC170052
0.9608 High Similarity NPC127406
0.9605 High Similarity NPC83283
0.9605 High Similarity NPC210003
0.9605 High Similarity NPC143851
0.9605 High Similarity NPC39360
0.9605 High Similarity NPC29763
0.956 High Similarity NPC209550
0.956 High Similarity NPC116864
0.956 High Similarity NPC277532
0.956 High Similarity NPC244776
0.956 High Similarity NPC175429
0.956 High Similarity NPC138990
0.9551 High Similarity NPC298171
0.9551 High Similarity NPC131745
0.9548 High Similarity NPC136761
0.9545 High Similarity NPC44931
0.9545 High Similarity NPC65003
0.9545 High Similarity NPC473512
0.9545 High Similarity NPC60966
0.9545 High Similarity NPC129827
0.9545 High Similarity NPC288084
0.9545 High Similarity NPC6985
0.9545 High Similarity NPC43638
0.95 High Similarity NPC175107
0.95 High Similarity NPC11847
0.95 High Similarity NPC217822
0.95 High Similarity NPC101399
0.95 High Similarity NPC474522
0.95 High Similarity NPC190003
0.95 High Similarity NPC221288
0.95 High Similarity NPC153755
0.9494 High Similarity NPC256188
0.9494 High Similarity NPC221342
0.9494 High Similarity NPC142142
0.9494 High Similarity NPC203145
0.9494 High Similarity NPC11432
0.9494 High Similarity NPC32641
0.9494 High Similarity NPC476470
0.9494 High Similarity NPC477613
0.9494 High Similarity NPC186816
0.9494 High Similarity NPC189564
0.9494 High Similarity NPC12013
0.949 High Similarity NPC183672
0.9487 High Similarity NPC195685
0.9487 High Similarity NPC477629
0.9487 High Similarity NPC270675
0.9487 High Similarity NPC477628
0.9487 High Similarity NPC210961
0.9487 High Similarity NPC472994
0.9484 High Similarity NPC73511
0.9484 High Similarity NPC473634
0.9484 High Similarity NPC138811
0.9484 High Similarity NPC43761
0.9484 High Similarity NPC22062
0.9481 High Similarity NPC206378
0.9477 High Similarity NPC106625
0.9441 High Similarity NPC4390
0.9437 High Similarity NPC470712
0.9437 High Similarity NPC96605
0.9437 High Similarity NPC235260
0.9437 High Similarity NPC20505
0.9437 High Similarity NPC164704
0.9437 High Similarity NPC218161
0.9437 High Similarity NPC469344
0.9437 High Similarity NPC280642
0.9437 High Similarity NPC155763
0.9437 High Similarity NPC188815
0.9434 High Similarity NPC173637
0.9434 High Similarity NPC127546
0.9434 High Similarity NPC52550
0.9434 High Similarity NPC317489
0.9434 High Similarity NPC84362
0.9434 High Similarity NPC223424
0.943 High Similarity NPC289667
0.943 High Similarity NPC287889
0.943 High Similarity NPC135358
0.943 High Similarity NPC76831
0.943 High Similarity NPC292929
0.9427 High Similarity NPC259834
0.9423 High Similarity NPC473623
0.9419 High Similarity NPC122809
0.9419 High Similarity NPC156457
0.9419 High Similarity NPC161749
0.9419 High Similarity NPC197896
0.9419 High Similarity NPC313163
0.9419 High Similarity NPC258035
0.9416 High Similarity NPC169248
0.9416 High Similarity NPC99233
0.9416 High Similarity NPC97052
0.9416 High Similarity NPC26195
0.9416 High Similarity NPC39351
0.9416 High Similarity NPC72649
0.9412 High Similarity NPC88484
0.9412 High Similarity NPC259182
0.9412 High Similarity NPC259767
0.9412 High Similarity NPC121001
0.9408 High Similarity NPC191154
0.9383 High Similarity NPC264735
0.9379 High Similarity NPC470716
0.9379 High Similarity NPC470714
0.9379 High Similarity NPC470715
0.9375 High Similarity NPC138927
0.9375 High Similarity NPC225434
0.9375 High Similarity NPC219904
0.9375 High Similarity NPC120099
0.9375 High Similarity NPC223747
0.9375 High Similarity NPC203050
0.9375 High Similarity NPC5319
0.9371 High Similarity NPC308404
0.9371 High Similarity NPC276222
0.9371 High Similarity NPC262222
0.9371 High Similarity NPC179950
0.9371 High Similarity NPC145038
0.9371 High Similarity NPC88789
0.9371 High Similarity NPC68592
0.9371 High Similarity NPC113968
0.9371 High Similarity NPC118284
0.9371 High Similarity NPC277174
0.9371 High Similarity NPC73855
0.9371 High Similarity NPC274618
0.9371 High Similarity NPC253662
0.9371 High Similarity NPC56077
0.9371 High Similarity NPC328940
0.9371 High Similarity NPC281131
0.9371 High Similarity NPC135599
0.9371 High Similarity NPC298666
0.9363 High Similarity NPC303913
0.9355 High Similarity NPC261866
0.9355 High Similarity NPC295613
0.9355 High Similarity NPC473657
0.9355 High Similarity NPC45165
0.9355 High Similarity NPC170475
0.9346 High Similarity NPC134819
0.9325 High Similarity NPC471669
0.9325 High Similarity NPC472385
0.9325 High Similarity NPC198324

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC85707 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
0.9419 High Similarity NPD4381 Clinical (unspecified phase)
0.9375 High Similarity NPD7804 Clinical (unspecified phase)
0.9264 High Similarity NPD4338 Clinical (unspecified phase)
0.9259 High Similarity NPD6797 Phase 2
0.9202 High Similarity NPD7251 Discontinued
0.9146 High Similarity NPD7808 Phase 3
0.9051 High Similarity NPD7075 Discontinued
0.9038 High Similarity NPD6801 Discontinued
0.9018 High Similarity NPD7054 Approved
0.8963 High Similarity NPD7472 Approved
0.8961 High Similarity NPD5403 Approved
0.8889 High Similarity NPD6799 Approved
0.8861 High Similarity NPD7096 Clinical (unspecified phase)
0.8848 High Similarity NPD7074 Phase 3
0.8831 High Similarity NPD5401 Approved
0.8805 High Similarity NPD3817 Phase 2
0.879 High Similarity NPD4380 Phase 2
0.8727 High Similarity NPD3818 Discontinued
0.8688 High Similarity NPD5402 Approved
0.8606 High Similarity NPD6168 Clinical (unspecified phase)
0.8606 High Similarity NPD6167 Clinical (unspecified phase)
0.8606 High Similarity NPD6166 Phase 2
0.859 High Similarity NPD4378 Clinical (unspecified phase)
0.8553 High Similarity NPD6599 Discontinued
0.8521 High Similarity NPD6559 Discontinued
0.85 High Similarity NPD7411 Suspended
0.8497 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.8497 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.8447 Intermediate Similarity NPD1934 Approved
0.8442 Intermediate Similarity NPD1549 Phase 2
0.8395 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8302 Intermediate Similarity NPD1512 Approved
0.8295 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.8293 Intermediate Similarity NPD3882 Suspended
0.8293 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.8282 Intermediate Similarity NPD2801 Approved
0.8239 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.8232 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.8194 Intermediate Similarity NPD2796 Approved
0.8176 Intermediate Similarity NPD1511 Approved
0.8171 Intermediate Similarity NPD7819 Suspended
0.814 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.8129 Intermediate Similarity NPD1510 Phase 2
0.8101 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.8059 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8011 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7987 Intermediate Similarity NPD1240 Approved
0.7987 Intermediate Similarity NPD3750 Approved
0.7974 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7965 Intermediate Similarity NPD3751 Discontinued
0.7941 Intermediate Similarity NPD3787 Discontinued
0.7898 Intermediate Similarity NPD8312 Approved
0.7898 Intermediate Similarity NPD8313 Approved
0.7885 Intermediate Similarity NPD1607 Approved
0.7882 Intermediate Similarity NPD6959 Discontinued
0.7875 Intermediate Similarity NPD4628 Phase 3
0.7866 Intermediate Similarity NPD1653 Approved
0.7862 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7857 Intermediate Similarity NPD7768 Phase 2
0.7849 Intermediate Similarity NPD7435 Discontinued
0.7848 Intermediate Similarity NPD1551 Phase 2
0.7844 Intermediate Similarity NPD8455 Phase 2
0.7819 Intermediate Similarity NPD7584 Approved
0.7816 Intermediate Similarity NPD5844 Phase 1
0.7812 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7811 Intermediate Similarity NPD3749 Approved
0.7791 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7746 Intermediate Similarity NPD7784 Clinical (unspecified phase)
0.7742 Intermediate Similarity NPD6798 Discontinued
0.7733 Intermediate Similarity NPD6232 Discontinued
0.7719 Intermediate Similarity NPD5494 Approved
0.7707 Intermediate Similarity NPD1933 Approved
0.7701 Intermediate Similarity NPD7473 Discontinued
0.7697 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD6233 Phase 2
0.7688 Intermediate Similarity NPD6776 Approved
0.7688 Intermediate Similarity NPD6779 Approved
0.7688 Intermediate Similarity NPD6781 Approved
0.7688 Intermediate Similarity NPD6782 Approved
0.7688 Intermediate Similarity NPD6778 Approved
0.7688 Intermediate Similarity NPD6777 Approved
0.7688 Intermediate Similarity NPD6780 Approved
0.7684 Intermediate Similarity NPD7685 Pre-registration
0.7674 Intermediate Similarity NPD7199 Phase 2
0.7673 Intermediate Similarity NPD7033 Discontinued
0.7673 Intermediate Similarity NPD3748 Approved
0.7661 Intermediate Similarity NPD919 Approved
0.7633 Intermediate Similarity NPD1465 Phase 2
0.7613 Intermediate Similarity NPD6832 Phase 2
0.7604 Intermediate Similarity NPD7874 Approved
0.7604 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7593 Intermediate Similarity NPD1652 Phase 2
0.7592 Intermediate Similarity NPD7585 Approved
0.759 Intermediate Similarity NPD920 Approved
0.7557 Intermediate Similarity NPD7228 Approved
0.7552 Intermediate Similarity NPD8151 Discontinued
0.7539 Intermediate Similarity NPD7583 Approved
0.7532 Intermediate Similarity NPD1203 Approved
0.7528 Intermediate Similarity NPD5953 Discontinued
0.7516 Intermediate Similarity NPD2935 Discontinued
0.7514 Intermediate Similarity NPD7286 Phase 2
0.7514 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD6190 Approved
0.75 Intermediate Similarity NPD1091 Approved
0.75 Intermediate Similarity NPD7458 Discontinued
0.7485 Intermediate Similarity NPD1243 Approved
0.7484 Intermediate Similarity NPD5124 Phase 1
0.7484 Intermediate Similarity NPD6355 Discontinued
0.7484 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7474 Intermediate Similarity NPD7697 Approved
0.7474 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7474 Intermediate Similarity NPD7698 Approved
0.7474 Intermediate Similarity NPD7783 Phase 2
0.7474 Intermediate Similarity NPD7696 Phase 3
0.7471 Intermediate Similarity NPD37 Approved
0.747 Intermediate Similarity NPD2534 Approved
0.747 Intermediate Similarity NPD2532 Approved
0.747 Intermediate Similarity NPD2533 Approved
0.747 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7469 Intermediate Similarity NPD7266 Discontinued
0.7457 Intermediate Similarity NPD6234 Discontinued
0.7455 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7442 Intermediate Similarity NPD4966 Approved
0.7442 Intermediate Similarity NPD4967 Phase 2
0.7442 Intermediate Similarity NPD4965 Approved
0.7435 Intermediate Similarity NPD8319 Approved
0.7435 Intermediate Similarity NPD8320 Phase 1
0.7435 Intermediate Similarity NPD7871 Phase 2
0.7435 Intermediate Similarity NPD7870 Phase 2
0.7419 Intermediate Similarity NPD6534 Approved
0.7419 Intermediate Similarity NPD6535 Approved
0.741 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7409 Intermediate Similarity NPD7701 Phase 2
0.7405 Intermediate Similarity NPD2313 Discontinued
0.7405 Intermediate Similarity NPD3268 Approved
0.7391 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.7386 Intermediate Similarity NPD422 Phase 1
0.7378 Intermediate Similarity NPD2800 Approved
0.7377 Intermediate Similarity NPD8434 Phase 2
0.7371 Intermediate Similarity NPD1247 Approved
0.7365 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7358 Intermediate Similarity NPD4062 Phase 3
0.7355 Intermediate Similarity NPD3225 Approved
0.7348 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7346 Intermediate Similarity NPD2799 Discontinued
0.7338 Intermediate Similarity NPD9717 Approved
0.7329 Intermediate Similarity NPD6651 Approved
0.7326 Intermediate Similarity NPD4363 Phase 3
0.7326 Intermediate Similarity NPD4360 Phase 2
0.7312 Intermediate Similarity NPD1613 Approved
0.7312 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.731 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7308 Intermediate Similarity NPD2797 Approved
0.7302 Intermediate Similarity NPD7700 Phase 2
0.7302 Intermediate Similarity NPD7699 Phase 2
0.7296 Intermediate Similarity NPD7801 Approved
0.7294 Intermediate Similarity NPD3226 Approved
0.7289 Intermediate Similarity NPD3887 Approved
0.7289 Intermediate Similarity NPD2354 Approved
0.7288 Intermediate Similarity NPD3926 Phase 2
0.7283 Intermediate Similarity NPD8150 Discontinued
0.7278 Intermediate Similarity NPD4908 Phase 1
0.7273 Intermediate Similarity NPD1547 Clinical (unspecified phase)
0.7267 Intermediate Similarity NPD230 Phase 1
0.7267 Intermediate Similarity NPD4340 Discontinued
0.7261 Intermediate Similarity NPD2798 Approved
0.724 Intermediate Similarity NPD6823 Phase 2
0.7237 Intermediate Similarity NPD1548 Phase 1
0.7228 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7198 Intermediate Similarity NPD7240 Approved
0.7188 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7178 Intermediate Similarity NPD7097 Phase 1
0.716 Intermediate Similarity NPD447 Suspended
0.716 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7152 Intermediate Similarity NPD2346 Discontinued
0.7152 Intermediate Similarity NPD2344 Approved
0.7134 Intermediate Similarity NPD4308 Phase 3
0.7126 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7124 Intermediate Similarity NPD9545 Approved
0.7118 Intermediate Similarity NPD5049 Phase 3
0.7099 Intermediate Similarity NPD943 Approved
0.7099 Intermediate Similarity NPD4060 Phase 1
0.7093 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7091 Intermediate Similarity NPD6100 Approved
0.7091 Intermediate Similarity NPD6099 Approved
0.7089 Intermediate Similarity NPD3266 Approved
0.7089 Intermediate Similarity NPD3267 Approved
0.7086 Intermediate Similarity NPD4288 Approved
0.7069 Intermediate Similarity NPD6844 Discontinued
0.7063 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7051 Intermediate Similarity NPD1610 Phase 2
0.7048 Intermediate Similarity NPD2355 Clinical (unspecified phase)
0.7048 Intermediate Similarity NPD2353 Approved
0.7044 Intermediate Similarity NPD1019 Discontinued
0.7039 Intermediate Similarity NPD5710 Approved
0.7039 Intermediate Similarity NPD5711 Approved
0.7019 Intermediate Similarity NPD3027 Phase 3
0.7015 Intermediate Similarity NPD7930 Approved
0.7011 Intermediate Similarity NPD5889 Approved
0.7011 Intermediate Similarity NPD5890 Approved

Structure

External Identifiers

PubChem CID   10459196
ChEMBL   CHEMBL240954
ZINC  

Physicochemical Properties

Molecular Weight:  516.13
ALogP:  -3.1736
MLogP:  2.89
XLogP:  1.505
# Rotatable Bonds:  14
Polar Surface Area:  178.28
# H-Bond Aceptor:  8
# H-Bond Donor:  4
# Rings:  4
# Heavy Atoms:  37

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Structure MOL file  
Source Organisms  
Biological Activities  
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