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O14746 | TERT_HUMAN | Telomerase reverse transcriptase (TERT)

3D structures mapped by conservation among orthologs

[ Domain: "helical bundle domain in reverse transcriptase-like polymerases" // KOG1005 ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL443683 OBDepict H 3 C O N O N N H 3 C O O N N S O N N O O N IC50 = 0.64 nM 582.51 Cc1oc2nc1-c1nc(co1)-c1nc(co1)-c1nc(co1)-c1nc(co1)-c1nc(co1)C1=NC(CS1)c1nc-2c(C)o1 Homo sapiens CHEMBL926068 cell-based format
CHEMBL259739 OBDepict O HN N + N N CH 3 HN O + N CH 3 IC50 = 1.5 nM 550.62 C[n+]1cc(NC(=O)c2ccc3ccc4ccc(C(=O)Nc5cc6ccccc6[n+](C)c5)nc4c3n2)cc2ccccc21 Homo sapiens CHEMBL926068 cell-based format
CHEMBL3347538 OBDepict H 3 C O N O N N CH 3 O O N H N S O N N O O N IC50 = 5.0 nM 582.51 Cc1oc2nc1-c1nc(co1)-c1nc(co1)-c1nc(co1)-c1nc(co1)-c1nc(co1)C1=N[C@H](CS1)c1nc-2c(C)o1 Homo sapiens CHEMBL3391067 single protein format
CHEMBL3948172 OBDepict CH 3 O O O HO IC50 = 12.6 nM 198.22 CC1CCCC2(OC(O)C=CC2=O)O1 Homo sapiens CHEMBL3862957 cell-based format
CHEMBL1078511 OBDepict O HN N N NH N H N O H 3 C N IC50 = 18.0 nM 585.8 CN1CCCC1CCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL140180 OBDepict CH 3 N CH 3 HN N HN N H O O N N IC50 = 18.0 nM 545.73 CN(C)CCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3347541 OBDepict H 2 N H N H O N O N O O N N O O N N O O N IC50 = 20.0 nM 597.5 NCCCC[C@@H]1NC(=O)c2coc(n2)-c2coc(n2)-c2coc(n2)-c2coc(n2)-c2coc(n2)-c2coc(n2)-c2coc1n2 Homo sapiens CHEMBL3391067 single protein format
CHEMBL139511 OBDepict O NH N N NH N H NH 2 O N IC50 = 20.0 nM 565.72 Nc1ccccc1Nc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL2425367 OBDepict CH 3 N CH 3 N H N N N H N CH 3 CH 3 IC50 = 28.0 nM 508.71 CN(C)CCCNCc1ccc2nc3ccc4cc5cc(CNCCCN(C)C)ccc5nc4c3cc2c1 Homo sapiens CHEMBL2427719 single protein format
CHEMBL224754 OBDepict O N O + N CH 3 CH 3 CH 3 O N O + N H 3 C H 3 C CH 3 IC50 = 30.0 nM 562.67 C[N+](C)(C)CCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CC[N+](C)(C)C)C5=O Homo sapiens CHEMBL918789 cell-based format
CHEMBL336444 OBDepict O NH N N NH N H O O CH 3 N IC50 = 40.0 nM 592.74 CC(=O)c1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL2260109 OBDepict H 3 C S N N NH N N H N N N N CH 3 H 3 C H 3 C CH 3 H 3 C CH 3 IC50 = 41.0 nM 525.69 CSc1nc(Nc2ccc3nc(C)cc(N(C)C)c3c2)nc(Nc2ccc3nc(C)cc(N(C)C)c3c2)n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL336434 OBDepict O NH N N NH N H O N H 3 C CH 3 N IC50 = 45.0 nM 593.78 CN(C)c1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1 Homo sapiens CHEMBL926068 cell-based format
CHEMBL2298058 OBDepict H 3 C S N N NH N N H N NH 2 N NH 2 H 3 C CH 3 IC50 = 49.0 nM 469.58 CSc1nc(Nc2ccc3nc(C)cc(N)c3c2)nc(Nc2ccc3nc(C)cc(N)c3c2)n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL138811 OBDepict O N H N N NH N H O N IC50 = 50.0 nM 514.67 O=C(CCN1CCCC1)Nc1ccc2c(NC3CC3)c3ccc(NC(=O)CCN4CCCC4)cc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL141540 OBDepict O HN N N NH N H N O N IC50 = 50.0 nM 585.8 O=C(CCN1CCCC1)Nc1ccc2c(NCCN3CCCCC3)c3ccc(NC(=O)CCN4CCCC4)cc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3330787 OBDepict CH 3 NH HN O S O HN N H NH NH 2 ClH IC50 = 50.0 nM 473.0 CNCCNc1c2c(c(NCCNC(=N)N)c3sccc13)C(=O)c1ccccc1C2=O.Cl Homo sapiens CHEMBL3364665 cell-based format
CHEMBL2298055 OBDepict NH 2 N N N H N HN N NH 2 N NH 2 H 3 C CH 3 IC50 = 51.0 nM 438.5 Cc1cc(N)c2cc(Nc3nc(N)nc(Nc4ccc5nc(C)cc(N)c5c4)n3)ccc2n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL409247 OBDepict O N H N + N HN O CH 3 + N CH 3 IC50 = 52.0 nM 449.51 C[n+]1cc(NC(=O)c2cccc(C(=O)Nc3cc4ccccc4[n+](C)c3)n2)cc2ccccc21 Homo sapiens CHEMBL926068 cell-based format
CHEMBL2298050 OBDepict CH 3 + N CH 3 H 2 N N H N N N H N NH 2 + N NH 2 H 3 C H 3 C IC50 = 56.0 nM 496.62 CC[n+]1c(C)cc(N)c2cc(Nc3nc(N)nc(Nc4ccc5c(c4)c(N)cc(C)[n+]5CC)n3)ccc21 Homo sapiens CHEMBL3070227 single protein format
CHEMBL335132 OBDepict CH 3 N H 3 C NH N NH N H O O N N IC50 = 60.0 nM 559.76 CN(C)CCCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL336417 OBDepict O NH N N NH N H NH 2 O N IC50 = 60.0 nM 565.72 Nc1cccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL225205 OBDepict OH NH N O O O N O NH HO IC50 = 60.0 nM 564.6 O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1CCNCCO)c64)C(=O)N(CCNCCO)C5=O Homo sapiens CHEMBL918789 cell-based format
CHEMBL343795 OBDepict O HN N N NH N H O F N IC50 = 70.0 nM 568.7 O=C(CCN1CCCC1)Nc1ccc2c(Nc3ccc(F)cc3)c3ccc(NC(=O)CCN4CCCC4)cc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL335819 OBDepict O NH N N NH N H O H 2 N N IC50 = 74.0 nM 565.72 Nc1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL337762 OBDepict NH 2 HN N N H N H O O N N IC50 = 80.0 nM 565.72 Nc1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3ccc(NC(=O)CCN4CCCC4)cc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL138187 OBDepict CH 3 N H 3 C N H N N H N H O O N N IC50 = 80.0 nM 559.76 CN(C)CCCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2ccc(NC(=O)CCN3CCCC3)cc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL139287 OBDepict O HN N N NH N H O N IC50 = 90.0 nM 556.76 O=C(CCN1CCCC1)Nc1ccc2c(NC3CCCCC3)c3ccc(NC(=O)CCN4CCCC4)cc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL27323 OBDepict O HN CH 3 O HO IC50 = 93.0 nM 331.37 C/C(=CC(=O)Nc1ccccc1C(=O)O)c1ccc2ccccc2c1 Homo sapiens CHEMBL2175307 cell-based format
CHEMBL138487 OBDepict O NH N N NH N H N O H 3 C CH 3 N IC50 = 100.0 nM 593.78 CN(C)c1cccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL1997011 OBDepict CH 3 HN N H O O O HN O NH CH 3 IC50 = 100.0 nM 408.46 CCNCC(=O)Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)CNCC)cc1C2=O Homo sapiens CHEMBL2427719 single protein format
CHEMBL2111043 OBDepict CH 3 + N H 2 N N H N N HN NH 2 IC50 = 100.0 nM 460.57 CC[n+]1c(-c2ccccc2)c2cc(N/N=N/c3cccc(C(=N)N)c3)ccc2c2ccc(N)cc21 Homo sapiens CHEMBL2427719 single protein format
CHEMBL138761 OBDepict CH 3 S HN N HN N H O O N N IC50 = 100.0 nM 596.8 CSc1cccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3cc(NC(=O)CCN4CCCC4)ccc23)c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL343609 OBDepict O N H N N N H NH 2 HN O N IC50 = 110.0 nM 565.72 Nc1ccccc1Nc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2ccc(NC(=O)CCN3CCCC3)cc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3417316 OBDepict OH N H O H 3 C H H 3 C CH 3 CH 3 CH 3 O CH 3 OH IC50 = 110.0 nM 493.69 CC1=C(O)C(=O)C=C2C1=CC=C1[C@@]3(C)CC[C@@]4(C)CC[C@@](C)(C(=O)NCCO)C[C@H]4[C@]3(C)CC[C@@]21C Homo sapiens CHEMBL3418582 single protein format
CHEMBL2260108 OBDepict NH 2 N N N H N HN + N + N CH 3 CH 3 IC50 = 130.0 nM 410.49 C[n+]1cccc2cc(Nc3nc(N)nc(Nc4ccc5c(ccc[n+]5C)c4)n3)ccc21 Homo sapiens CHEMBL3070227 single protein format
CHEMBL225211 OBDepict N O O OH OH OH HO IC50 = 130.0 nM 311.25 N#Cc1c(-c2ccc(O)c(O)c2)oc2c(O)c(O)ccc2c1=O Homo sapiens CHEMBL917191 cell-based format
CHEMBL335564 OBDepict CH 3 O HN N HN N H O O N N IC50 = 140.0 nM 532.69 COCCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL574043 OBDepict H 3 C N CH 3 HN N N H N CH 3 H 3 C IC50 = 150.0 nM 407.61 CN(C)CCCNCc1cccc2cc3cccc(CNCCCN(C)C)c3nc12 Homo sapiens CHEMBL1041235 cell-based format
CHEMBL137809 OBDepict CH 3 S HN N HN N H O O N N IC50 = 150.0 nM 596.8 CSc1ccccc1Nc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2cc(NC(=O)CCN3CCCC3)ccc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL484670 OBDepict CH 3 N CH 3 NH N + N H CH 3 _ I IC50 = 160.0 nM 488.42 CCN(CC)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL225001 OBDepict CH 3 N H 3 C N O O O N O N H 3 C H 3 C IC50 = 160.0 nM 532.6 CN(C)CCN1C(=O)c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C1=O)c64)C(=O)N(CCN(C)C)C5=O Homo sapiens CHEMBL918789 cell-based format
CHEMBL345035 OBDepict O N H N N NH NH 2 N H O N IC50 = 170.0 nM 565.72 Nc1ccccc1Nc1c2cc(NC(=O)CCN3CCCC3)ccc2nc2ccc(NC(=O)CCN3CCCC3)cc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL138357 OBDepict O N H N N N H HN N O CH 3 H 3 C N IC50 = 170.0 nM 593.78 CN(C)c1ccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3ccc(NC(=O)CCN4CCCC4)cc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL1256678 OBDepict CH 3 O H H H CH 3 H N H N O O IC50 = 200.0 nM 464.65 COc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](NCCCCCCN3C(=O)C=CC3=O)CC[C@@H]12 Homo sapiens CHEMBL3111567 cell-based format
CHEMBL222541 OBDepict HO HO O O OH OH IC50 = 200.0 nM 286.24 O=c1cc(-c2ccc(O)c(O)c2)oc2c(O)c(O)ccc12 Homo sapiens CHEMBL917191 cell-based format
CHEMBL142036 OBDepict O N H N N NH N H H 2 N O N IC50 = 200.0 nM 565.72 Nc1ccc(Nc2c3cc(NC(=O)CCN4CCCC4)ccc3nc3ccc(NC(=O)CCN4CCCC4)cc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL361868 OBDepict CH 3 N N H O N OH N H O N H 3 C IC50 = 200.0 nM 531.7 CC1CCN(CCC(=O)Nc2ccc3c(O)c4cc(NC(=O)CCN5CCC(C)CC5)ccc4nc3c2)CC1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3707105 OBDepict OH N N H O N O H N H O N HO IC50 = 200.0 nM 591.75 O=C(CCN1CCCCC1CCO)Nc1ccc2c(=O)c3cc(NC(=O)CCN4CCCCC4CCO)ccc3[nH]c2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL491633 OBDepict H 3 C N H 3 C HN N + N H CH 3 F _ I IC50 = 200.0 nM 506.41 CCN(CC)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccc(F)cc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL186346 OBDepict OH N N H O N OH N H O N HO IC50 = 200.0 nM 535.65 O=C(CCN1CCC(O)CC1)Nc1ccc2c(O)c3cc(NC(=O)CCN4CCC(O)CC4)ccc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL342480 OBDepict O N H N N N H NH NH 2 O N IC50 = 210.0 nM 565.72 Nc1cccc(Nc2c3ccc(NC(=O)CCN4CCCC4)cc3nc3ccc(NC(=O)CCN4CCCC4)cc23)c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL137973 OBDepict O HN N N NH NH O N IC50 = 210.0 nM 556.76 O=C(CCN1CCCC1)Nc1ccc2c(NC3CCCCC3)c3cc(NC(=O)CCN4CCCC4)ccc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL1078502 OBDepict O HN N N NH N H O N IC50 = 210.0 nM 570.78 O=C(CCN1CCCC1)Nc1ccc2c(NC3CCCCCC3)c3ccc(NC(=O)CCN4CCCC4)cc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL2298051 OBDepict H 3 C N CH 3 N N N H N N H + N NH 2 + N H 2 N H 3 C CH 3 H 3 C CH 3 IC50 = 220.0 nM 496.62 Cc1cc(N)c2cc(Nc3nc(Nc4ccc5c(c4)c(N)cc(C)[n+]5C)nc(N(C)C)n3)ccc2[n+]1C Homo sapiens CHEMBL3070227 single protein format
CHEMBL2425365 OBDepict O N H N NH O + N N CH 3 CH 3 H 3 C CH 3 + N H 3 C IC50 = 220.0 nM 506.61 Cc1cc(N(C)C)c2cc(NC(=O)c3cccc(C(=O)Nc4ccc5c(ccc[n+]5C)c4)n3)ccc2[n+]1C Homo sapiens CHEMBL2427719 single protein format
CHEMBL507633 OBDepict H 3 C N CH 3 HN N + N H CH 3 _ I IC50 = 220.0 nM 460.36 CN(C)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL2298066 OBDepict NH 2 N N N H N HN + N NH 2 + N NH 2 CH 3 CH 3 H 3 C CH 3 IC50 = 250.0 nM 468.57 Cc1cc(N)c2cc(Nc3nc(N)nc(Nc4ccc5c(c4)c(N)cc(C)[n+]5C)n3)ccc2[n+]1C Homo sapiens CHEMBL3070227 single protein format
CHEMBL156480 OBDepict H 3 C N CH 3 + N Cl CH 3 Cl H 3 C O S O O _ O IC50 = 250.0 nM 491.4 COS(=O)(=O)[O-].Cc1cc2c3c([n+](C)c4ccc(Cl)cc4c3c1)-c1cc(Cl)ccc1N2C Homo sapiens CHEMBL813592 single protein format
CHEMBL158365 OBDepict CH 3 N CH 3 + N H 3 C CH 3 CH 3 H 3 C O S O O _ O IC50 = 250.0 nM 450.56 COS(=O)(=O)[O-].Cc1ccc2c(c1)-c1c3c(cc(C)cc3c3cc(C)ccc3[n+]1C)N2C Homo sapiens CHEMBL813592 single protein format
CHEMBL140084 OBDepict CH 3 N H 3 C N H N N H N H O O N N IC50 = 270.0 nM 545.73 CN(C)CCNc1c2ccc(NC(=O)CCN3CCCC3)cc2nc2ccc(NC(=O)CCN3CCCC3)cc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL490013 OBDepict H 3 C N H 3 C HN N + N H CH 3 F F _ I IC50 = 270.0 nM 524.4 CCN(CC)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1c(F)cc(F)cc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL2298053 OBDepict H 3 C N H N N NH N N H N NH N HN H 3 C CH 3 H 3 C CH 3 IC50 = 300.0 nM 480.58 CNc1nc(Nc2ccc3nc(C)cc(NC)c3c2)nc(Nc2ccc3nc(C)cc(NC)c3c2)n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL491432 OBDepict CH 3 N H 3 C NH N + N H CH 3 F _ I IC50 = 310.0 nM 478.35 CN(C)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccc(F)cc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL158083 OBDepict H 3 C N CH 3 + N F CH 3 F H 3 C O S O O _ O IC50 = 330.0 nM 458.49 COS(=O)(=O)[O-].Cc1cc2c3c([n+](C)c4ccc(F)cc4c3c1)-c1cc(F)ccc1N2C Homo sapiens CHEMBL813592 single protein format
CHEMBL2298063 OBDepict H 3 C S N N N NH N H N NH 2 N N H 3 C CH 3 H 3 C CH 3 IC50 = 340.0 nM 497.63 CSc1nc(Nc2ccc3nc(C)cc(N)c3c2)nc(Nc2ccc3nc(C)cc(N(C)C)c3c2)n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL3417317 OBDepict H 3 C N H OH O CH 3 H CH 3 CH 3 CH 3 H 3 C O CH 3 HO IC50 = 340.0 nM 507.72 CCC(O)NC(=O)[C@]1(C)CC[C@]2(C)CC[C@]3(C)C4=CC=C5C(=CC(=O)C(O)=C5C)[C@]4(C)CC[C@@]3(C)[C@@H]2C1 Homo sapiens CHEMBL3418582 single protein format
CHEMBL482414 OBDepict H 3 C N CH 3 HN O + N CH 3 _ I IC50 = 370.0 nM 461.35 CN(C)CCCNc1c2ccccc2[n+](C)c2c1oc1ccccc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL157766 OBDepict CH 3 + N N CH 3 _ I IC50 = 380.0 nM 424.29 CN1c2ccccc2-c2c3c1cccc3c1ccccc1[n+]2C.[I-] Homo sapiens CHEMBL813592 single protein format
CHEMBL3347644 OBDepict O N H HO O O HO OH OH IC50 = 380.0 nM 405.36 O=C(Nc1c(-c2ccc(O)c(O)c2)oc2ccccc2c1=O)c1ccc(O)c(O)c1 Homo sapiens CHEMBL3391288 cell-based format
CHEMBL186019 OBDepict O N H N N HO N H O N IC50 = 400.0 nM 503.65 O=C(CCN1CCCCC1)Nc1ccc2c(O)c3cc(NC(=O)CCN4CCCCC4)ccc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3109742 OBDepict _ O + N O O Cl Cl IC50 = 400.0 nM 310.14 O=[N+]([O-])/C=C/c1cccc(Oc2cc(Cl)cc(Cl)c2)c1 Homo sapiens CHEMBL3111568 single protein format
CHEMBL489811 OBDepict H 3 C N CH 3 HN N + N H CH 3 F F _ I IC50 = 400.0 nM 496.34 CN(C)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1c(F)cc(F)cc12.[I-] Homo sapiens CHEMBL1024719 cell-based format
CHEMBL224755 OBDepict N N N N IC50 = 400.0 nM 556.8 c1cc2c3ccc4c5c(ccc(c6ccc7c(c1CN(CCN1CCCCC1)C7)c26)c53)CN(CCN1CCCCC1)C4 Homo sapiens CHEMBL918789 cell-based format
CHEMBL141740 OBDepict CH 3 O HN N N H N H O O N N IC50 = 460.0 nM 580.73 COc1ccc(Nc2c3cc(NC(=O)CCN4CCCC4)ccc3nc3ccc(NC(=O)CCN4CCCC4)cc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3359606 OBDepict CH 3 N H HN NH S O O NH HN NH H 3 C ClH IC50 = 470.0 nM 499.04 CC(=N)NCCNc1c2c(c(NCCNC(C)=N)c3sccc13)C(=O)c1ccccc1C2=O.Cl Homo sapiens CHEMBL3364664 cell-based format
CHEMBL376279 OBDepict CH 3 O O O H 3 C O N N H N CH 3 H 3 C IC50 = 470.0 nM 407.47 COc1ccc2c(=O)cc(-c3ccc4[nH]c(CCCN(C)C)nc4c3)oc2c1OC Homo sapiens CHEMBL917191 cell-based format
CHEMBL3109740 OBDepict O N H H 3 C O HO N O IC50 = 470.0 nM 416.48 C/C(=CC(=O)Nc1ccc(N2CCOCC2)cc1C(=O)O)c1ccc2ccccc2c1 Homo sapiens CHEMBL3111564 cell-based format
CHEMBL2297965 OBDepict CH 3 N H 2 N N H N N N H N NH 2 H 3 C IC50 = 490.0 nM 422.5 Cc1cc(N)c2cc(Nc3ccnc(Nc4ccc5nc(C)cc(N)c5c4)n3)ccc2n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL359965 OBDepict CH 2 S + S _ O CH 2 IC50 = 500.0 nM 162.28 C=CCS[S+]([O-])CC=C Homo sapiens CHEMBL3391294 cell-based format
CHEMBL3330785 OBDepict H 2 N NH NH HN S O O NH 2 ClH IC50 = 500.0 nM 415.91 Cl.N=C(N)NCCNc1c2c(c(N)c3ccsc13)C(=O)c1ccccc1C2=O Homo sapiens CHEMBL3364665 cell-based format
CHEMBL2164966 OBDepict CH 3 O O O O H O H 2 C H H H H 3 C H CH 3 H H 3 C O OH IC50 = 500.0 nM 432.51 C=C1C(=O)[C@]2(OC)C(=O)O[C@@]34C[C@H](C)C(C(=O)O)=C[C@@H]3CCC[C@@H](C)C[C@@H](C)[C@H]1O[C@H]24 Homo sapiens CHEMBL3111565 single protein format
CHEMBL341985 OBDepict O N H N N NH N H N O H 3 C CH 3 N IC50 = 500.0 nM 593.78 CN(C)c1ccc(Nc2c3cc(NC(=O)CCN4CCCC4)ccc3nc3ccc(NC(=O)CCN4CCCC4)cc23)cc1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL51931 OBDepict O O IC50 = 500.0 nM 208.22 O=C1C(=O)c2ccccc2-c2ccccc21 Homo sapiens CHEMBL2160264 cell-based format
CHEMBL274335 OBDepict CH 3 N H 3 C NH N H N + N O _ O IC50 = 500.0 nM 413.48 CN(C)CCCNc1[nH]c2ccccc2c2nc3c(ccc4ccc([N+](=O)[O-])cc43)c1-2 Homo sapiens CHEMBL878872 single protein format
CHEMBL187266 OBDepict O O O CH 3 CH 3 H 3 C IC50 = 500.0 nM 294.35 Cc1coc2c1C(=O)C(=O)c1c-2ccc2c1CCCC2(C)C Homo sapiens CHEMBL2160264 cell-based format
CHEMBL2298052 OBDepict H 3 C N H N N NH N N H N NH 2 N NH 2 H 3 C CH 3 IC50 = 510.0 nM 452.53 CNc1nc(Nc2ccc3nc(C)cc(N)c3c2)nc(Nc2ccc3nc(C)cc(N)c3c2)n1 Homo sapiens CHEMBL3070227 single protein format
CHEMBL137928 OBDepict CH 3 N CH 3 HN N N H N H O O N N IC50 = 570.0 nM 545.73 CN(C)CCNc1c2cc(NC(=O)CCN3CCCC3)ccc2nc2ccc(NC(=O)CCN3CCCC3)cc12 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL139443 OBDepict O N H N N NH N H N H 3 C CH 3 O N IC50 = 600.0 nM 593.78 CN(C)c1cccc(Nc2c3cc(NC(=O)CCN4CCCC4)ccc3nc3ccc(NC(=O)CCN4CCCC4)cc23)c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3330786 OBDepict CH 3 NH HN S O O HN N H NH NH 2 ClH IC50 = 600.0 nM 473.0 CNCCNc1c2c(c(NCCNC(=N)N)c3ccsc13)C(=O)c1ccccc1C2=O.Cl Homo sapiens CHEMBL3364664 cell-based format
CHEMBL222354 OBDepict HO HO O F O OH OH IC50 = 600.0 nM 304.23 O=c1c(F)c(-c2ccc(O)c(O)c2)oc2c(O)c(O)ccc12 Homo sapiens CHEMBL917191 cell-based format
CHEMBL186971 OBDepict H 3 C N CH 3 N H O N OH N H O N CH 3 H 3 C IC50 = 600.0 nM 423.52 CN(C)CCC(=O)Nc1ccc2nc3ccc(NC(=O)CCN(C)C)cc3c(O)c2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL219728 OBDepict H 3 C N CH 3 HN N N H IC50 = 630.0 nM 318.42 CN(C)CCCNc1c2ccccc2nc2c1[nH]c1ccccc12 Homo sapiens CHEMBL1024719 cell-based format
CHEMBL2170856 OBDepict O N H OH OH N H O OH OH IC50 = 670.0 nM 380.36 O=C(Nc1cccc(NC(=O)c2cccc(O)c2O)c1)c1cccc(O)c1O Homo sapiens CHEMBL2175305 cell-based format
CHEMBL3330790 OBDepict CH 3 N H HN S O O HN NH CH 3 ClH IC50 = 700.0 nM 444.99 CNCCNc1c2c(c(NCCNC)c3sccc13)C(=O)c1ccccc1C2=O.Cl Homo sapiens CHEMBL3364664 cell-based format
CHEMBL3330789 OBDepict H 2 N NH S O O NH HN NH H 2 N ClH IC50 = 700.0 nM 473.0 Cl.N=C(N)NCCNc1c2c(c(NCCCN)c3sccc13)C(=O)c1ccccc1C2=O Homo sapiens CHEMBL3364664 cell-based format
CHEMBL186933 OBDepict CH 3 N CH 3 N H O N OH N H O N H 3 C H 3 C IC50 = 700.0 nM 479.63 CCN(CC)CCC(=O)Nc1ccc2c(O)c3cc(NC(=O)CCN(CC)CC)ccc3nc2c1 Homo sapiens CHEMBL1105835 cell-based format
CHEMBL3330791 OBDepict NH 2 N H HN NH S O O NH HN NH H 2 N ClH IC50 = 700.0 nM 501.02 Cl.N=C(N)NCCNc1c2c(c(NCCNC(=N)N)c3sccc13)C(=O)c1ccccc1C2=O Homo sapiens CHEMBL3364664 cell-based format
CHEMBL44441 OBDepict O N H OH NH OH O OH OH IC50 = 720.0 nM 380.36 O=C(Nc1ccccc1NC(=O)c1ccc(O)c(O)c1)c1ccc(O)c(O)c1 Homo sapiens CHEMBL3391288 cell-based format
CHEMBL2298056 OBDepict NH 2 N N N H N HN HN NH 2 NH NH 2 IC50 = 740.0 nM 364.42 N=C(N)c1ccc(Nc2nc(N)nc(NC3=CCC(C(=N)N)C=C3)n2)cc1 Homo sapiens CHEMBL3070227 single protein format