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P47898 | 5HT5A_HUMAN | 5-hydroxytryptamine receptor 5A (HTR5A)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL3654198 OBDepict F F F N F N O NH 2 H 2 N Ki = 0.68 nM 366.32 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cc(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654206 OBDepict H 2 N N NH 2 N O F F F Ki = 0.75 nM 374.37 NC(N)=NC(=O)N1Cc2c(-c3c(F)cccc3F)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654212 OBDepict F F N F N O NH 2 H 2 N Ki = 0.85 nM 374.37 NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654208 OBDepict F F F N F N O NH 2 H 2 N Ki = 0.88 nM 392.36 NC(N)=NC(=O)N1Cc2c(-c3c(F)cc(F)cc3F)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654214 OBDepict NH 2 N H 2 N N O F F Ki = 0.95 nM 356.38 NC(N)=NC(=O)N1Cc2c(-c3ccccc3F)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL1210154 OBDepict O N H O N CH 3 S IC50 = 1.0 nM 336.42 C/C(=NOC(=O)Nc1ccccc1)c1cccc(-c2cccs2)c1 Homo sapiens CHEMBL1212500 cell-based format
CHEMBL93240 OBDepict CH 3 S S N N H 3 C Ki = 1.0 nM 356.56 CSc1ccc2c(c1)C(N1CCN(C)CC1)Cc1ccccc1S2 Homo sapiens CHEMBL620713 single protein format
CHEMBL3654199 OBDepict NH 2 N H 2 N N O F F F Ki = 1.1 nM 348.33 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3c(F)cccc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654197 OBDepict F F F N Cl N O NH 2 H 2 N Ki = 1.1 nM 382.77 NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cc(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644535 OBDepict NH 2 N H 2 N O N Cl F F Ki = 1.2 nM 360.75 NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3c(F)cccc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3644525 OBDepict F F Cl N N O H 2 N NH 2 Ki = 1.3 nM 360.75 NC(N)=NC(=O)c1ccc2ncc(Cl)c(-c3ccc(F)cc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3644530 OBDepict F F F N H 3 C N O NH 2 H 2 N Ki = 1.3 nM 358.32 Cc1cnc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc12 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654210 OBDepict H 2 N N NH 2 N O F F F F Ki = 1.3 nM 392.36 NC(N)=NC(=O)N1Cc2c(-c3cc(F)c(F)cc3F)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644528 OBDepict NH 2 N H 2 N O N F F F Ki = 1.4 nM 344.3 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3644527 OBDepict NH 2 N H 2 N O N F F Cl Ki = 1.6 nM 360.75 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cccc3Cl)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654207 OBDepict NH 2 N H 2 N N O H 3 C F F F Ki = 1.6 nM 362.36 CC1CN(C(=O)N=C(N)N)Cc2c(-c3c(F)cccc3F)ccc(F)c21 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL404372 OBDepict H H 3 C HN H 2 N N Cl Ki = 1.6 nM 195.65 C[C@@H]1NC(N)=Nc2cccc(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL256694 OBDepict F F N H NH N H CH 3 Cl Cl Ki = 1.8 nM 294.13 C[C@@H]1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL3644540 OBDepict NH 2 N H 2 N O N CH 3 F Ki = 1.8 nM 322.34 Cc1cnc(-c2ccccc2F)c2cc(C(=O)N=C(N)N)ccc12 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654205 OBDepict Cl N Cl N F N O H 2 N NH 2 Ki = 1.9 nM 382.23 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3Cl)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644537 OBDepict NH 2 N H 2 N O N CH 3 F F Ki = 1.9 nM 340.33 Cc1cnc(-c2c(F)cccc2F)c2cc(C(=O)N=C(N)N)ccc12 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL273170 OBDepict NH 2 NH N CH 3 Cl Cl Ki = 2.0 nM 230.1 CC1NC(N)=Nc2ccc(Cl)c(Cl)c21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL3644541 OBDepict F F N Cl N O H 2 N NH 2 Ki = 2.3 nM 360.75 NC(N)=NC(=O)c1ccc2c(Cl)cnc(-c3ccc(F)cc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654204 OBDepict NH 2 N H 2 N N O Cl F F N Ki = 2.5 nM 365.77 NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3c(F)cncc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654209 OBDepict NH 2 N H 2 N N O F Ki = 2.7 nM 302.35 NC(N)=NC(=O)N1Cc2c(C3CC3)ccc(F)c2C2(CC2)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654200 OBDepict F F N Cl N O H 2 N NH 2 Ki = 2.7 nM 364.78 NC(N)=NC(=O)N1CCc2c(Cl)ccc(-c3ccc(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL24462 OBDepict OH N HN Ki = 3.0 nM 228.29 Oc1ccc2cccc(N3CCNCC3)c2c1 Homo sapiens CHEMBL618085 single protein format
CHEMBL3644533 OBDepict NH 2 N H 2 N O N F F Ki = 3.3 nM 326.31 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3644534 OBDepict NH 2 N H 2 N O N F Cl Ki = 3.4 nM 342.76 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccccc3Cl)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654196 OBDepict NH 2 N H 2 N N O F F F Ki = 3.6 nM 348.33 NC(N)=NC(=O)N1CCc2cccc(-c3cc(F)c(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654211 OBDepict NH 2 N H 2 N N O F F F F Ki = 3.7 nM 366.32 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3cc(F)c(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644526 OBDepict F F F H 3 C CH 3 N N O H 2 N NH 2 Ki = 3.7 nM 372.35 Cc1nc2ccc(C(=O)N=C(N)N)cc2c(-c2c(F)cc(F)cc2F)c1C Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654203 OBDepict F N F N CH 3 N O H 2 N NH 2 Ki = 3.9 nM 345.35 Cc1ccc(-c2ncc(F)cc2F)c2c1CCN(C(=O)N=C(N)N)C2 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644529 OBDepict F Cl N F N O H 2 N NH 2 Ki = 4.1 nM 360.75 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ccc(F)cc3Cl)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3654213 OBDepict NH 2 N H 2 N N O N F F Ki = 4.2 nM 331.33 NC(N)=NC(=O)N1CCc2cccc(-c3ncc(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3654195 OBDepict Cl N F N F N O H 2 N NH 2 Ki = 4.3 nM 365.77 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(Cl)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644539 OBDepict NH 2 N H 2 N O N F F F F Ki = 4.6 nM 376.31 NC(N)=NC(=O)c1ccc2c(C(F)F)cnc(-c3c(F)cccc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL3644536 OBDepict NH 2 N H 2 N O N F F Cl N Ki = 4.7 nM 361.74 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3Cl)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL401745 OBDepict CH 3 O N Cl CH 3 H 2 N HN CH 3 Ki = 4.7 nM 239.71 COc1cc(Cl)c(C)c2c1N=C(N)NC2C Homo sapiens CHEMBL930817 cell-based format
CHEMBL3763779 OBDepict CH 3 O N N N O ClH Ki = 5.0 nM 478.04 COc1ccccc1N1CCN(CCCCC(=O)n2c3ccccc3c3ccccc32)CC1.Cl Homo sapiens CHEMBL3768265 single protein format
CHEMBL270177 OBDepict CH 3 NH NH 2 N Cl Ki = 5.1 nM 195.65 CC1NC(N)=Nc2cccc(Cl)c21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL3644531 OBDepict NH 2 N H 2 N O N F F F N Ki = 5.3 nM 345.28 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3c(F)cncc3F)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL429136 OBDepict F F N H NH N CH 3 Cl Cl Ki = 5.7 nM 294.13 CC1NC(NCC(F)F)=Nc2ccc(Cl)c(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL3644538 OBDepict F N Cl N F N O H 2 N NH 2 Ki = 6.2 nM 361.74 NC(N)=NC(=O)c1ccc2c(F)cnc(-c3ncc(F)cc3Cl)c2c1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL408152 OBDepict CH 3 O N H 2 N HN CH 3 Ki = 6.3 nM 191.23 COc1cccc2c1N=C(N)NC2C Homo sapiens CHEMBL930817 cell-based format
CHEMBL271298 OBDepict CH 3 NH N H N Cl CH 3 Cl Ki = 6.3 nM 244.13 CNC1=Nc2ccc(Cl)c(Cl)c2C(C)N1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL272781 OBDepict H 2 N HN N CH 3 Cl Cl Ki = 6.5 nM 230.1 CC1NC(N)=Nc2c(Cl)ccc(Cl)c21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL3654202 OBDepict F F N Cl F N O H 2 N NH 2 Ki = 6.6 nM 382.77 NC(N)=NC(=O)N1Cc2c(-c3ccc(F)cc3F)ccc(Cl)c2C(F)C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL541993 OBDepict F F N H NH N H CH 3 Cl Ki = 6.8 nM 259.69 C[C@@H]1NC(NCC(F)F)=Nc2cccc(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL3654201 OBDepict F N F N F N O H 2 N NH 2 Ki = 6.9 nM 349.32 NC(N)=NC(=O)N1CCc2c(F)ccc(-c3ncc(F)cc3F)c2C1 Homo sapiens CHEMBL3706332 cell-based format
CHEMBL3644532 OBDepict CH 3 O F N F N O NH 2 H 2 N Ki = 7.1 nM 356.33 COc1cccc(F)c1-c1ncc(F)c2ccc(C(=O)N=C(N)N)cc12 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL263881 OBDepict H 3 C N O CH 3 H N CH 3 H N H Ki = 9.0 nM 323.44 CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL618087 single protein format
CHEMBL258075 OBDepict CH 3 O CH 3 N H 2 N HN CH 3 Ki = 10.0 nM 219.29 CC(C)Oc1cccc2c1N=C(N)NC2C Homo sapiens CHEMBL930817 cell-based format
CHEMBL274384 OBDepict H 3 C N O CH 3 H N CH 3 H N Br H Ki < 10.0 nM 402.34 CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]c(Br)c(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL618085 single protein format
CHEMBL433352 OBDepict H 3 C N O CH 3 H N CH 3 H N I H Ki < 10.0 nM 449.34 CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]c(I)c(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL618085 single protein format
CHEMBL404511 OBDepict F F N H NH N CH 3 Cl Ki = 10.1 nM 259.69 CC1NC(NCC(F)F)=Nc2cccc(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL269964 OBDepict CH 3 NH N H N Cl CH 3 Ki = 10.8 nM 209.68 CNC1=Nc2cccc(Cl)c2C(C)N1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL96504 OBDepict F O N N CH 3 Ki = 13.0 nM 338.43 Cn1c2c(c3ccccc31)CN(CCCOc1ccc(F)cc1)CC2 Homo sapiens CHEMBL618085 single protein format
CHEMBL138989 OBDepict CH 3 N H N O N H H 3 C H CH 3 H Ki = 13.0 nM 335.45 C[C@@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 Homo sapiens CHEMBL618087 single protein format
CHEMBL3644524 OBDepict F F F CH 3 N N O NH 2 H 2 N Ki = 13.0 nM 358.32 Cc1cc(-c2c(F)cc(F)cc2F)c2cc(C(=O)N=C(N)N)ccc2n1 Homo sapiens CHEMBL3705795 cell-based format
CHEMBL137781 OBDepict CH 3 N H N O N H CH 3 H H 3 C H Ki = 16.0 nM 335.45 C[C@H]1C[C@@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 Homo sapiens CHEMBL875092 single protein format
CHEMBL18840 OBDepict NH 2 N H O H 2 N Ki = 20.0 nM 203.25 NCCc1c[nH]c2ccc(C(N)=O)cc12 Homo sapiens CHEMBL620713 single protein format
CHEMBL446459 OBDepict F F NH NH N CH 3 O H 3 C CH 3 Ki = 22.2 nM 283.32 CC(C)Oc1cccc2c1N=C(NCC(F)F)NC2C Homo sapiens CHEMBL930054 single protein format
CHEMBL257744 OBDepict H 3 C O Cl CH 3 NH N N H F F Ki = 22.2 nM 289.71 COc1c(Cl)ccc2c1C(C)NC(NCC(F)F)=N2 Homo sapiens CHEMBL930054 single protein format
CHEMBL258073 OBDepict CH 3 O Cl CH 3 HN N H 2 N Ki = 22.9 nM 225.68 COc1c(Cl)ccc2c1C(C)NC(N)=N2 Homo sapiens CHEMBL930817 cell-based format
CHEMBL270841 OBDepict H 3 C HN H 2 N N Ki = 24.0 nM 175.24 CCC1NC(N)=Nc2ccccc21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL402179 OBDepict CH 3 NH NH N CH 3 O H 3 C CH 3 Ki = 25.4 nM 233.31 CNC1=Nc2c(OC(C)C)cccc2C(C)N1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL439240 OBDepict H 3 C HN H 2 N N Cl Cl Ki = 26.5 nM 244.12 CCC1NC(N)=Nc2ccc(Cl)c(Cl)c21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL343755 OBDepict CH 3 N H N O N H H 3 C H CH 3 H Ki = 27.0 nM 335.45 C[C@H]1C[C@H](C)N1C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)CC2N(C)C1 Homo sapiens CHEMBL618087 single protein format
CHEMBL404248 OBDepict H 3 C O N NH NH CH 3 F F Ki = 28.2 nM 255.27 COc1cccc2c1N=C(NCC(F)F)NC2C Homo sapiens CHEMBL930054 single protein format
CHEMBL271253 OBDepict F F N H NH N CH 3 Cl Cl Ki = 33.4 nM 294.13 CC1NC(NCC(F)F)=Nc2c(Cl)ccc(Cl)c21 Homo sapiens CHEMBL930054 single protein format
CHEMBL256693 OBDepict CH 3 HN N H N O O Ki = 37.0 nM 309.37 CC1NC(NCC2COc3ccccc3O2)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format
CHEMBL541396 OBDepict NH 2 NH N CH 3 IH Ki = 38.0 nM 289.12 CC1NC(N)=Nc2ccccc21.I Homo sapiens CHEMBL930817 cell-based format
CHEMBL277120 OBDepict HN N Ki = 40.0 nM 212.3 c1ccc2c(N3CCNCC3)cccc2c1 Homo sapiens CHEMBL618085 single protein format
CHEMBL442 OBDepict H N H N CH 3 H HN O CH 3 O O N OH H N H O Ki = 40.0 nM 581.67 CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL618085 single protein format
CHEMBL1548 OBDepict NH 2 NH N Cl Cl Ki = 43.0 nM 216.07 NC1=Nc2ccc(Cl)c(Cl)c2CN1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL282199 OBDepict H 3 C N H N S O O HO Ki = 65.0 nM 352.5 CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 Homo sapiens CHEMBL620708 single protein format
CHEMBL494675 OBDepict HN N Ki = 76.0 nM 238.33 c1ccc(-c2ccccc2N2CCNCC2)cc1 Homo sapiens CHEMBL4369146 cell-based format
CHEMBL39 OBDepict H 2 N N H OH IC50 = 79.0 nM 176.22 NCCc1c[nH]c2ccc(O)cc12 Homo sapiens CHEMBL871865 single protein format
CHEMBL270176 OBDepict CH 3 NH NH 2 N Cl Ki = 84.4 nM 209.68 CCC1NC(N)=Nc2cccc(Cl)c21 Homo sapiens CHEMBL930817 cell-based format
CHEMBL272355 OBDepict F F N H NH N CH 3 Ki = 87.0 nM 225.24 CC1NC(NCC(F)F)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format
CHEMBL2442272 OBDepict H N N H Br NH O NH Ki = 89.0 nM 305.13 N=C1NC(=O)/C(=Cc2c[nH]c3ccc(Br)cc23)N1 Homo sapiens CHEMBL2445942 cell-based format
CHEMBL404365 OBDepict CH 3 HN N H N O O Ki = 96.0 nM 261.32 CC1NC(NCC2COCCO2)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format
CHEMBL552782 OBDepict H 3 C O N NH 2 NH IH Ki = 97.0 nM 305.12 COc1cccc2c1N=C(N)NC2.I Homo sapiens CHEMBL930817 cell-based format
CHEMBL2164327 OBDepict H 3 C N N CH 3 CH 3 H N H 3 C H 3 C Ki = 98.5 nM 283.42 Cc1nn(C)c(C)c1-c1cccc2c1CC[C@H](N(C)C)C2 Homo sapiens CHEMBL4369141 single protein format
CHEMBL556983 OBDepict NH 2 NH N Cl BrH Ki = 99.0 nM 262.54 Br.NC1=Nc2cccc(Cl)c2CN1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL401541 OBDepict NH 2 NH N Cl Ki = 99.0 nM 181.63 NC1=Nc2cccc(Cl)c2CN1 Homo sapiens CHEMBL930817 cell-based format
CHEMBL3139682 OBDepict Cl N H N NH 2 Ki < 100.0 nM 325.84 Nc1ccc2ccc(CCNCCc3cccc(Cl)c3)cc2n1 Homo sapiens CHEMBL4041197 cell-based format
CHEMBL128848 OBDepict CH 3 N N O Ki = 100.0 nM 320.44 Cn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 Homo sapiens CHEMBL620717 single protein format
CHEMBL128099 OBDepict CH 3 N N O Ki = 100.0 nM 334.46 CCn1c2c(c3ccccc31)CN(CCCOc1ccccc1)CC2 Homo sapiens CHEMBL620717 single protein format
CHEMBL2442270 OBDepict HN HN N H O N H Ki = 101.0 nM 226.24 N=C1NC(=O)/C(=Cc2c[nH]c3ccccc23)N1 Homo sapiens CHEMBL2445942 cell-based format
CHEMBL272517 OBDepict CH 3 NH NH N CH 3 Ki = 103.0 nM 175.24 CNC1=Nc2ccccc2C(C)N1 Homo sapiens CHEMBL930054 single protein format
CHEMBL4128926 OBDepict OH O H H N H O N S S HN O O CH 3 CH 3 CH 3 IC50 = 106.0 nM 583.78 CC(C)(C)NS(=O)(=O)c1ccc(-c2sc(C(=O)N[C@H]3C[C@H](C(=O)O)C3)nc2CC2CCCCC2)c2ccccc12 Homo sapiens CHEMBL4121503 single protein format
CHEMBL2442274 OBDepict H N Br N H NH O NH Ki = 112.0 nM 305.13 N=C1NC(=O)/C(=Cc2c[nH]c3c(Br)cccc23)N1 Homo sapiens CHEMBL2445942 cell-based format
CHEMBL402400 OBDepict CH 3 N H N H N Ki = 122.0 nM 215.3 CC1NC(NC2CCC2)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format
CHEMBL2442271 OBDepict NH NH N H O N H Br Ki = 123.0 nM 305.13 N=C1NC(=O)/C(=Cc2c[nH]c3cccc(Br)c23)N1 Homo sapiens CHEMBL2445942 cell-based format
CHEMBL257302 OBDepict CH 3 NH N H N Ki = 124.0 nM 271.41 CC1NC(NCCC2CCCCC2)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format
CHEMBL537248 OBDepict CH 3 NH N NH 2 IH Ki = 145.0 nM 289.12 Cc1cccc2c1CNC(N)=N2.I Homo sapiens CHEMBL930817 cell-based format
CHEMBL270658 OBDepict CH 3 N H NH N CH 3 Ki = 153.0 nM 203.29 CCCNC1=Nc2ccccc2C(C)N1 Homo sapiens CHEMBL930054 single protein format
CHEMBL403102 OBDepict CH 3 HN N H N H O Ki = 163.0 nM 245.33 CC1NC(NC[C@H]2CCCO2)=Nc2ccccc21 Homo sapiens CHEMBL930054 single protein format