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P35462 | DRD3_HUMAN | D(3) dopamine receptor (DRD3)

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
CHEMBL349426 OBDepict H N H HN N N N Ki = 0.02 nM 415.59 c1ccc(N2CCN(CC[C@H]3CC[C@H](Nc4ncnc5ccccc45)CC3)CC2)cc1 Homo sapiens CHEMBL674835 cell-based format
CHEMBL80919 OBDepict O NH S H H N N Cl Cl Ki = 0.02 nM 466.48 O=C(N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1)c1cccs1 Homo sapiens CHEMBL669160 cell-based format
CHEMBL3905247 OBDepict O N H N H H H N N N S Ki = 0.029 nM 487.67 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL8514 OBDepict H N OH CH 3 H 3 C CH 3 H Ki = 0.04 nM 361.53 CC(C)(C)[C@]1(O)CCN2C[C@H]3c4ccccc4CCc4cccc(c43)[C@@H]2C1 Homo sapiens CHEMBL3297336 cell-based format
CHEMBL3966842 OBDepict H N H N H S O O S N N S Ki = 0.043 nM 490.72 O=S(=O)(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1cccs1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3918755 OBDepict O N H HN H H N N N S Ki = 0.043 nM 463.65 O=C(Nc1ccccc1)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3895540 OBDepict CH 3 N S O O S H H N N N S Ki = 0.046 nM 504.75 CN([C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)S(=O)(=O)c1cccs1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3920252 OBDepict O N H H H N N N S Ki = 0.047 nM 448.64 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1ccccc1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3932186 OBDepict Cl S N N N H H N H O O Ki = 0.051 nM 473.04 O=C(NC[C@H]1CC[C@H](CN2CCN(c3nsc4cc(Cl)ccc34)CC2)CC1)c1ccco1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3902496 OBDepict H 3 C NH O H H N N N S Ki = 0.052 nM 400.59 CCC(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3896937 OBDepict O N H HN H N H N N N S Ki = 0.055 nM 464.64 O=C(Nc1cccnc1)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3976282 OBDepict O N H S H H N N N S Ki = 0.056 nM 454.67 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1cccs1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3933256 OBDepict H N H N H S N O O N N S Ki = 0.058 nM 485.68 O=S(=O)(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1cccnc1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3982486 OBDepict H 3 C O NH O H H N N N S Ki = 0.058 nM 416.59 CCOC(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3948056 OBDepict CH 3 S N H O O H H N N N S Ki = 0.062 nM 498.72 Cc1ccc(S(=O)(=O)N[C@H]2CC[C@H](CCN3CCN(c4nsc5ccccc45)CC3)CC2)cc1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL1765633 OBDepict CH 3 N H N N HN O Ki = 0.076 nM 430.6 CCCN(CCCCNC(=O)c1ccc(-c2ccccc2)cc1)[C@H]1CCn2nccc2C1 Homo sapiens CHEMBL1768394 cell-based format
CHEMBL3967779 OBDepict O N H N H H N N N S Ki = 0.09 nM 449.62 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1cccnc1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL2024517 OBDepict O N N H CH 3 H 3 C H H N N Cl Cl ClH Ki = 0.09 nM 463.88 CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1.Cl Homo sapiens CHEMBL2026140 single protein format
CHEMBL3892440 OBDepict H N H N H S O O CH 3 N N S Ki = 0.095 nM 422.62 CS(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL462508 OBDepict O N H N N N Cl Cl Ki = 0.099 nM 457.41 O=C(NCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cc2ccccc2cn1 Homo sapiens CHEMBL954164 cell-based format
CHEMBL3409256 OBDepict NH 2 O O N N N S O O Ki = 0.1 nM 518.64 NC(=O)c1ccccc1OCCCN1CCN(c2cccc3c2ccn3S(=O)(=O)c2ccccc2)CC1 Homo sapiens CHEMBL3413558 cell-based format
CHEMBL496531 OBDepict Cl Cl N N N O N Ki = 0.105 nM 471.43 O=C1c2cc3ccccc3n2CCN1CCCCN1CCN(c2cccc(Cl)c2Cl)CC1 Homo sapiens CHEMBL954164 cell-based format
CHEMBL286252 OBDepict H 3 C N NH O O H 3 C N Ki = 0.11 nM 365.48 CCCCN1CCCC1CNC(=O)c1cc(C#N)c2ccccc2c1OC Homo sapiens CHEMBL673835 single protein format
CHEMBL3597643 OBDepict O HN N H N N Ki = 0.118 nM 426.56 O=C(NCCCCN1CCN(c2cccc3ccccc23)CC1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL3599874 cell-based format
CHEMBL1771110 OBDepict H 3 C O N N N O S Ki = 0.12 nM 475.66 COc1ccccc1N1CCN(CCCCN2CCc3cc(-c4cccs4)ccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL464395 OBDepict H 3 C O N N O N N S Ki = 0.12 nM 464.64 COc1ccccc1N1CCN(CCCCOc2ccc(C3CN4C=CSC4=N3)cc2)CC1 Homo sapiens CHEMBL938624 single protein format
CHEMBL2397389 OBDepict CH 3 N H N H HC O Ki = 0.12 nM 414.59 C#CC1=CC[C@H](N(CCC)CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1 Homo sapiens CHEMBL2400819 cell-based format
CHEMBL1771112 OBDepict CH 3 O N N N O N Ki = 0.12 nM 470.62 COc1ccccc1N1CCN(CCCCN2CCc3cc(-c4ccncc4)ccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL3597645 OBDepict O NH S N N Ki = 0.128 nM 443.62 O=C(NCCCCN1CCN(c2cccc3ccccc23)CC1)c1cc2ccccc2s1 Homo sapiens CHEMBL3599874 cell-based format
CHEMBL3946995 OBDepict O N H O H H N N N S Ki = 0.13 nM 438.6 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1ccco1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL196476 OBDepict CH 3 O O N H O N N Cl Cl Ki = 0.13 nM 476.4 COc1cccc2cc(C(=O)NCCCCN3CCN(c4cccc(Cl)c4Cl)CC3)oc12 Homo sapiens CHEMBL861745 cell-based format
CHEMBL495572 OBDepict Cl Cl N N O N Ki = 0.14 nM 444.41 Clc1cccc(N2CCN(CCCCCOc3cc4ccccc4cn3)CC2)c1Cl Homo sapiens CHEMBL954164 cell-based format
CHEMBL3962525 OBDepict H 3 C NH O H H N N N S Ki = 0.14 nM 414.62 CCCC(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL309623 OBDepict H N H NH N O Ki = 0.14 nM 397.61 O=C(N[C@H]1CC[C@H](CCN2CCN(c3ccccc3)CC2)CC1)C1CCCCC1 Homo sapiens CHEMBL674835 cell-based format
CHEMBL4544583 OBDepict CH 3 Cl N N HN O N H Ki = 0.142 nM 439.0 CCc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl Homo sapiens CHEMBL4429154 cell-based format
CHEMBL4476699 OBDepict CH 3 Cl N N HN O O Ki = 0.153 nM 439.99 CCc1cccc(N2CCN(CCCCNC(=O)c3cc4ccccc4o3)CC2)c1Cl Homo sapiens CHEMBL4429154 cell-based format
CHEMBL308524 OBDepict H 3 C N H HN O OH O I CH 3 O CH 3 Ki = 0.16 nM 434.27 CCN1CCC[C@H]1CNC(=O)c1c(O)c(I)cc(OC)c1OC Homo sapiens CHEMBL673249 cell-based format
CHEMBL1288585 OBDepict CH 3 N H H H O H HO Ki = 0.16 nM 246.34 CC[11CH2]N1CCO[C@@H]2c3cc(O)ccc3CC[C@H]21 Homo sapiens CHEMBL1291981 cell-based format
CHEMBL8946 OBDepict H 3 C N H HN O OH O CH 3 Cl CH 3 Ki = 0.16 nM 340.85 CCc1cc(Cl)c(OC)c(C(=O)NC[C@@H]2CCCN2CC)c1O Homo sapiens CHEMBL675049 cell-based format
CHEMBL3973487 OBDepict H 3 C NH O H H N N N S Ki = 0.16 nM 386.56 CC(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL1689006 OBDepict OH O O OH F O N N N H O S Ki = 0.17 nM 571.67 O=C(NCCCCN1CCN(c2ccccc2OCCF)CC1)c1ccc(-c2ccsc2)cc1.O=C(O)C(=O)O Homo sapiens CHEMBL1694506 cell-based format
CHEMBL2396663 OBDepict CH 3 N H N H HC O Ki = 0.17 nM 414.59 C#CC1=CC[C@@H](N(CCC)CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1 Homo sapiens CHEMBL2400819 cell-based format
CHEMBL4093656 OBDepict O N H N N N Cl Cl Ki = 0.172 nM 457.41 O=C(NCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cnc2ccccc2c1 Homo sapiens CHEMBL4052937 cell-based format
CHEMBL157138 OBDepict H 3 C N N H O H 3 C H N CH 3 H N H IC50 = 0.173 nM 338.46 CCN(CC)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL1909141 cell membrane format
CHEMBL3597644 OBDepict CH 3 O N H NH O N N Ki = 0.173 nM 456.59 COc1ccc2[nH]c(C(=O)NCCCCN3CCN(c4cccc5ccccc45)CC3)cc2c1 Homo sapiens CHEMBL3599874 cell-based format
CHEMBL339960 OBDepict Cl Cl N N NH O N H Ki = 0.18 nM 445.39 O=C(NCCCCN1CCN(c2ccc(Cl)cc2Cl)CC1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL954164 cell-based format
CHEMBL3133875 OBDepict OH O O OH H 3 C O N N NH O N H OH Ki = 0.18 nM 512.56 COc1ccccc1N1CCN(CCCCNC(=O)c2cc3cc(O)ccc3[nH]2)CC1.O=C(O)C(=O)O Homo sapiens CHEMBL3136929 cell-based format
CHEMBL3940712 OBDepict O N H HN H H N N N S Ki = 0.18 nM 477.68 O=C(NCc1ccccc1)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL602065 OBDepict CH 3 N H N HO N N Ki = 0.186 nM 444.62 CCCN(CCN1CCN(c2ccnc3ccccc23)CC1)[C@H]1CCc2c(O)cccc2C1 Homo sapiens CHEMBL1065655 cell-based format
CHEMBL210567 OBDepict CH 3 O N N N H O Ki = 0.19 nM 497.68 COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccc2CCc2ccc(cc2)CC3)CC1 Homo sapiens CHEMBL860508 cell-based format
CHEMBL569977 OBDepict H 3 C N H N O N H 3 C N Ki = 0.19 nM 458.65 CCCN(CCN1CCN(c2ccnc3ccccc23)CC1)[C@H]1CCc2c(cccc2OC)C1 Homo sapiens CHEMBL1050538 cell-based format
CHEMBL3929168 OBDepict O N H H H N N N S Ki = 0.19 nM 454.68 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)C1CCCCC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL4552939 OBDepict CH 3 Cl N N OH HN O N H Ki = 0.2 nM 455.0 CCc1cccc(N2CCN(CCC(O)CNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl Homo sapiens CHEMBL4429154 cell-based format
CHEMBL4567895 OBDepict CH 3 O N N N H O S Ki = 0.2 nM 449.62 COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccsc3)cc2)CC1 Homo sapiens CHEMBL4350892 cell-based format
CHEMBL58669 OBDepict CH 3 N N H OH O Ki = 0.2 nM 456.63 CCCN(CCCCNC(=O)c1ccc(-c2ccccc2)cc1)C1CCc2c(O)cccc2C1 Homo sapiens CHEMBL995089 cell-based format
CHEMBL3358104 OBDepict O HN N H N N F F F Ki = 0.2 nM 444.5 O=C(NCCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL3381714 single protein format
CHEMBL3759491 OBDepict OH N N N H O Ki = 0.2 nM 403.53 O=C(NCCCCN1CCN(c2cccc(O)c2)CC1)c1ccc2ccccc2c1 Homo sapiens CHEMBL3762402 cell-based format
CHEMBL1403281 OBDepict H 3 C CH 3 H N O N O HO O NH H H 3 C CH 3 O H N CH 3 H N H Ki = 0.2 nM 575.71 CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 Homo sapiens CHEMBL1909141 cell membrane format
CHEMBL135044 OBDepict OH O O OH OH O H N Ki = 0.2 nM 385.42 O=C(O)C(=O)O.Oc1ccc2c(c1)O[C@@H](CN1CCc3ccccc3C1)CC2 Homo sapiens CHEMBL673447 single protein format
CHEMBL484358 OBDepict CH 3 N N H HC O Ki = 0.21 nM 414.59 C#CC1=CCC(N(CCC)CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1 Homo sapiens CHEMBL995089 cell-based format
CHEMBL2112607 OBDepict H 3 C O O H 3 C N H O N F Ki = 0.21 nM 412.51 COc1cccc(C(=O)NC2CC3CCCC(C2)N3Cc2ccc(F)cc2)c1OC Homo sapiens CHEMBL673249 cell-based format
CHEMBL69271 OBDepict CH 3 N H O H HO Ki = 0.21 nM 247.34 CCCN1CCO[C@@H]2c3cc(O)ccc3CC[C@H]21 Homo sapiens CHEMBL673332 cell-based format
CHEMBL3956720 OBDepict O N H H H N N N S Ki = 0.21 nM 412.6 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)C1CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL3577346 OBDepict CH 3 N N N O O H 3 C N H O N H H 3 C HO Ki = 0.21 nM 591.8 CCCCn1cc(CCCOc2ccc(C(=O)NCCCCN(CCC)[C@H]3CCc4c(O)cccc4C3)cc2OC)nn1 Homo sapiens CHEMBL3578856 cell-based format
CHEMBL1771109 OBDepict H 3 C O N N N O O Ki = 0.21 nM 459.59 COc1ccccc1N1CCN(CCCCN2CCc3cc(-c4ccco4)ccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL102582 OBDepict CH 3 N O HO Ki = 0.21 nM 247.34 CCCN1CCOC2c3cc(O)ccc3CCC21 Homo sapiens CHEMBL872893 cell-based format
CHEMBL3920432 OBDepict H 3 C S NH O O H H N N N S Ki = 0.22 nM 450.67 CCCS(=O)(=O)N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL289330 OBDepict H 3 C N H HN O O Br CH 3 O CH 3 Ki = 0.22 nM 371.28 CCN1CCC[C@H]1CNC(=O)c1cc(Br)cc(OC)c1OC Homo sapiens CHEMBL982123 single protein format
CHEMBL424294 OBDepict H 3 C O N N NH O S Ki = 0.23 nM 423.58 COc1ccccc1N1CCN(CCCCNC(=O)c2cc3ccccc3s2)CC1 Homo sapiens CHEMBL674519 single protein format
CHEMBL3589652 OBDepict OH N HN N O Cl Cl Ki = 0.233 nM 510.46 O=C(NCCC(O)CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccc2c(c1)-c1ccccc1C2 Homo sapiens CHEMBL3591125 cell-based format
CHEMBL3970746 OBDepict O N H O H H N N N S + N O _ O Ki = 0.24 nM 483.59 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4cc([N+](=O)[O-])ccc34)CC2)CC1)c1ccco1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL2397479 OBDepict CH 3 N H HN CH O S Ki = 0.24 nM 394.58 C#CC1=CC[C@H](N(CCC)CCCCNC(=O)c2cc3ccccc3s2)CC1 Homo sapiens CHEMBL2400819 cell-based format
CHEMBL3596212 OBDepict O NH O N N Ki = 0.244 nM 427.55 O=C(NCCCCN1CCN(c2cccc3ccccc23)CC1)c1cc2ccccc2o1 Homo sapiens CHEMBL3599874 cell-based format
CHEMBL1771253 OBDepict CH 3 N S CH 3 N N N H 3 C S N F F F Ki = 0.25 nM 493.62 Cc1nc(C)c(-c2nnc(SCCCN3CCC4(c5ccc(C(F)(F)F)cc5)CC34)n2C)s1 Homo sapiens CHEMBL1771959 single protein format
CHEMBL1771107 OBDepict CH 3 O N N N O Ki = 0.25 nM 469.63 COc1ccccc1N1CCN(CCCCN2CCc3cc(-c4ccccc4)ccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL4571568 OBDepict N N N N H O S Ki = 0.25 nM 444.6 N#Cc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccsc3)cc2)CC1 Homo sapiens CHEMBL4350892 cell-based format
CHEMBL138998 OBDepict CH 3 N H N F O O Ki = 0.251 nM 428.59 CCCN(CCCCN1C(=O)CC2(CCCC2)CC1=O)[C@@H]1CCc2c(F)cccc2C1 Homo sapiens CHEMBL674410 single protein format
CHEMBL1627321 OBDepict OH HN N O N H N Cl Cl Ki = 0.26 nM 461.39 O=C(NCC(O)CCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cc2ccccc2[nH]1 Homo sapiens CHEMBL961810 cell-based format
CHEMBL267932 OBDepict F O N N O N CH 3 Ki = 0.265 nM 409.51 CN1CN(c2ccccc2)C2(CCN(CCCC(=O)c3ccc(F)cc3)CC2)C1=O Homo sapiens CHEMBL3270691 cell-based format
CHEMBL1771105 OBDepict H 3 C O O N N N O CH 3 Ki = 0.27 nM 437.58 COc1ccc2c(c1)CCCN(CCCCN1CCN(c3ccccc3OC)CC1)C2=O Homo sapiens CHEMBL1771857 cell-based format
CHEMBL461236 OBDepict Cl N N N H O N Ki = 0.27 nM 422.96 O=C(NCCCCN1CCN(c2cccc(Cl)c2)CC1)c1cc2ccccc2cn1 Homo sapiens CHEMBL954164 cell-based format
CHEMBL2028019 OBDepict O N N H CH 3 H 3 C H H N N Cl Cl Ki = 0.27 nM 427.42 CN(C)C(=O)N[C@H]1CC[C@H](CCN2CCN(c3cccc(Cl)c3Cl)CC2)CC1 Homo sapiens CHEMBL3295082 cell-based format
CHEMBL3913691 OBDepict O NH F F F H H N N N S Ki = 0.27 nM 440.54 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)C(F)(F)F Homo sapiens CHEMBL3872756 cell-based format
CHEMBL477206 OBDepict CH 3 O N N N O Ki = 0.27 nM 407.56 COc1ccccc1N1CCN(CCCCN2CCCc3ccccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL374749 OBDepict O N H N N Cl Ki = 0.28 nM 448.01 O=C(NCCCCN1CCN(c2ccccc2Cl)CC1)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL912015 cell-based format
CHEMBL836 OBDepict CH 3 O O N H CH 3 H S O O O NH 2 H 3 C Ki = 0.28 nM 408.52 CCOc1ccccc1OCCN[C@H](C)Cc1ccc(OC)c(S(N)(=O)=O)c1 Homo sapiens CHEMBL675666 single protein format
CHEMBL4865434 OBDepict H 3 C N H N H O OH O H 3 C Cl CH 3 Ki = 0.281 nM 354.88 CCCN1CCC[C@H]1CNC(=O)c1c(O)c(CC)cc(Cl)c1OC Homo sapiens CHEMBL4828546 cell membrane format
CHEMBL4519938 OBDepict CH 3 Cl N N HO H N H O N H Ki = 0.29 nM 455.0 CCc1cccc(N2CCN(C[C@H](O)CCNC(=O)c3cc4ccccc4[nH]3)CC2)c1Cl Homo sapiens CHEMBL4415925 cell-based format
CHEMBL297302 OBDepict F O N N OH N Ki = 0.29 nM 381.45 O=C(CCCN1CCC(n2c(O)nc3ccccc32)CC1)c1ccc(F)cc1 Homo sapiens CHEMBL3820061 cell-based format
CHEMBL1771111 OBDepict CH 3 O N N N O S Ki = 0.29 nM 489.69 COc1ccccc1N1CCN(CCCCN2CCCc3cc(-c4cccs4)ccc3C2=O)CC1 Homo sapiens CHEMBL1771857 cell-based format
CHEMBL179351 OBDepict O NH N N N H N Cl Cl Ki = 0.3 nM 470.4 O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1ccc(-c2ncc[nH]2)cc1 Homo sapiens CHEMBL838684 single protein format
CHEMBL112065 OBDepict CH 3 O N N N H O Ki = 0.3 nM 443.59 COc1ccccc1N1CCN(CCCCNC(=O)c2ccc(-c3ccccc3)cc2)CC1 Homo sapiens CHEMBL859710 cell-based format
CHEMBL3322994 OBDepict O HN N N N N Cl Cl Ki = 0.3 nM 446.38 O=C(NCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cn2ccccc2n1 Homo sapiens CHEMBL3379350 cell-based format
CHEMBL239923 OBDepict O N H N N Ki = 0.3 nM 491.68 O=C(NCCCCN1CCC(N(Cc2ccccc2)c2ccccc2)CC1)c1ccc2ccccc2c1 Homo sapiens CHEMBL897620 cell-based format
CHEMBL3358105 OBDepict O HN O N N F Ki = 0.3 nM 395.48 O=C(NCCCCN1CCN(c2ccccc2F)CC1)c1cc2ccccc2o1 Homo sapiens CHEMBL3381714 single protein format
CHEMBL3590080 OBDepict H 3 C N N H O F Ki = 0.31 nM 394.53 CCCN(CCCCNC(=O)/C=C/c1ccc(F)cc1)C1Cc2ccccc2C1 Homo sapiens CHEMBL3592695 cell-based format
CHEMBL4064974 OBDepict F O N N HN O N N Ki = 0.31 nM 439.54 O=C(NCCCCN1CCN(c2ccccc2OCCF)CC1)c1cc2ccccn2n1 Homo sapiens CHEMBL4054779 cell-based format
CHEMBL3938210 OBDepict O N H N H H H N N N S Ki = 0.31 nM 437.61 O=C(N[C@H]1CC[C@H](CCN2CCN(c3nsc4ccccc34)CC2)CC1)c1ccc[nH]1 Homo sapiens CHEMBL3872756 cell-based format
CHEMBL394292 OBDepict CH NH O N N Cl Cl Ki = 0.31 nM 430.38 C#Cc1ccc(C(=O)NCCCCN2CCN(c3cccc(Cl)c3Cl)CC2)cc1 Homo sapiens CHEMBL898787 cell-based format
CHEMBL3613880 OBDepict Cl Cl N N N N N N N Ki = 0.31 nM 470.41 Clc1cccc(N2CCN(CCCCc3cn(-c4ccn5nccc5c4)nn3)CC2)c1Cl Homo sapiens CHEMBL3614292 cell-based format