HOME LIGAND hPROTEOME OTHERS DOCUMENT

P28221 | 5HT1D_HUMAN | 5-hydroxytryptamine receptor 1D (HTR1D)

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
CHEMBL65824 OBDepict F F N N H N N N IC50 = 0.1 nM 435.52 Fc1ccccc1CC1(F)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616912 cell-based format
CHEMBL161723 OBDepict F N N N H N N N IC50 = 0.1 nM 418.52 Fc1ccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL112507 OBDepict H N N N N N OH IC50 = 0.1 nM 415.54 OC1(Cc2ccccc2)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616901 cell-based format
CHEMBL144030 OBDepict H 2 N N H O O N H H 2 N Ki = 0.11 nM 454.57 NCCc1c[nH]c2ccc(OCc3ccc(COc4ccc5[nH]cc(CCN)c5c4)cc3)cc12 Homo sapiens CHEMBL965238 cell-based format
CHEMBL65367 OBDepict H N N N N N N IC50 = 0.2 nM 400.53 c1ccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616910 cell-based format
CHEMBL161176 OBDepict CH 3 N H O N N N H N N N IC50 = 0.2 nM 457.58 CC(=O)Nc1cccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL49826 OBDepict H 3 C N H N H H 3 C H 3 C CH 3 Ki = 0.25 nM 270.42 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C(C)(C)C)cc12 Homo sapiens CHEMBL616935 single protein format
CHEMBL1203216 OBDepict H 2 N N H O N O N HN S N O O H 3 C H 3 C OH 2 ClH Ki = 0.26 nM 555.1 CN(C)S(=O)(=O)Nc1ccc(N2CCN(C(=O)COc3ccc4[nH]cc(CCN)c4c3)CC2)cc1.Cl.O Homo sapiens CHEMBL617304 single protein format
CHEMBL44054 OBDepict CH 3 N H N H H 3 C CH 3 Ki = 0.29 nM 256.39 CC(C)c1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1 Homo sapiens CHEMBL616935 single protein format
CHEMBL344127 OBDepict CH 3 O HN O N H N CH 3 H 3 C Ki = 0.3 nM 377.49 COc1ccc(CNC(=O)/C=C/c2ccc3[nH]cc(CCN(C)C)c3c2)cc1 Homo sapiens CHEMBL617093 cell-based format
CHEMBL296161 OBDepict CH 3 N H 3 C N H N N N IC50 = 0.3 nM 255.32 CN(C)CCc1c[nH]c2ccc(-n3cnnc3)cc12 Homo sapiens CHEMBL616909 cell-based format
CHEMBL366322 OBDepict CH 3 N H CH 3 H 3 C H 3 C CH 3 N H N Ki = 0.3 nM 245.37 Cc1cc(C(C)(C)C)cc(C)c1NC1=NCCN1 Homo sapiens CHEMBL829548 single protein format
CHEMBL63167 OBDepict H N N N N N F F F F IC50 = 0.3 nM 485.53 FC1(Cc2ccccc2C(F)(F)F)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616912 cell-based format
CHEMBL160070 OBDepict O O NH H N H N H NH H 3 C H IC50 = 0.3 nM 446.6 C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(C[C@H]4COC(=O)N4)cc23)C1)c1ccccc1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL422366 OBDepict H N N N N N N N IC50 = 0.3 nM 401.52 c1cncc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL114571 OBDepict CH 3 N H N H N HN O CH 3 Ki = 0.31 nM 428.58 Cc1ccc(NC(=O)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL2 OBDepict CH 3 O O N CH 3 N N H 2 N N O O Ki = 0.33 nM 383.41 COc1cc2nc(N3CCN(C(=O)c4ccco4)CC3)nc(N)c2cc1OC Homo sapiens CHEMBL646088 single protein format
CHEMBL121207 OBDepict H 2 N N H O N O N + N O _ O Ki = 0.34 nM 479.58 NCCc1c[nH]c2ccc(OCCCCCC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc12 Homo sapiens CHEMBL617304 single protein format
CHEMBL294547 OBDepict H N N N N N IC50 = 0.35 nM 399.54 c1ccc(CC2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616910 cell-based format
CHEMBL331970 OBDepict H N N N N N N H CH 3 H IC50 = 0.35 nM 428.58 C[C@@H](NC1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1)c1ccccc1 Homo sapiens CHEMBL616904 cell-based format
CHEMBL159483 OBDepict O O NH H N H N H N H IC50 = 0.35 nM 432.57 O=C1N[C@@H](Cc2ccc3[nH]cc(CCN4CC[C@@H](CNCc5ccccc5)C4)c3c2)CO1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL113950 OBDepict CH 3 N H N H N N SH CH 3 Ki = 0.38 nM 444.65 Cc1ccc(/N=C(S)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL120514 OBDepict H 2 N N H O N O N H 2 N Ki = 0.38 nM 449.6 NCCc1c[nH]c2ccc(OCCCCCC(=O)N3CCN(c4ccc(N)cc4)CC3)cc12 Homo sapiens CHEMBL617304 single protein format
CHEMBL114780 OBDepict CH 3 N H N H N N H O Cl Ki = 0.38 nM 449.0 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(C(=O)Nc4ccc(Cl)cc4)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL163573 OBDepict H N N N N N N N IC50 = 0.4 nM 401.52 c1ccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)nc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL762 OBDepict CH 3 CH 3 OH H 3 C H 3 C CH 3 N H N Ki = 0.4 nM 260.38 Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1 Homo sapiens CHEMBL875909 single protein format
CHEMBL162805 OBDepict H N N N N N N O IC50 = 0.4 nM 390.49 c1coc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL31217 OBDepict NH 2 N H O O N N CH 3 Ki = 0.4 nM 444.58 CN1CCN(c2cccc3ccc(OCCOc4ccc5[nH]cc(CCN)c5c4)cc23)CC1 Homo sapiens CHEMBL616921 single protein format
CHEMBL65765 OBDepict F F N N H N N N IC50 = 0.4 nM 435.52 Fc1cccc(CC2(F)CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616912 cell-based format
CHEMBL300519 OBDepict H 3 C N CH 3 N H CH 3 CH 3 Ki = 0.4 nM 230.35 CC(C)c1ccc2[nH]cc(CCN(C)C)c2c1 Homo sapiens CHEMBL616935 single protein format
CHEMBL334323 OBDepict H 2 N N H O N O N + N O _ O Ki = 0.42 nM 423.47 NCCc1c[nH]c2ccc(OCC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cc12 Homo sapiens CHEMBL617304 single protein format
CHEMBL431866 OBDepict CH 3 O N H N O N H H N CH 3 Ki = 0.42 nM 444.58 COc1ccc(NC(=O)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL423029 OBDepict CH 3 N H 3 C N H H 3 C H 3 C CH 3 Ki = 0.44 nM 244.38 CN(C)CCc1c[nH]c2ccc(C(C)(C)C)cc12 Homo sapiens CHEMBL616933 single protein format
CHEMBL326125 OBDepict H N N N N N OH N H IC50 = 0.45 nM 444.58 OC1(CNCc2ccccc2)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616901 cell-based format
CHEMBL349185 OBDepict H N N N N N H N H O IC50 = 0.45 nM 390.49 c1cc(CNC[C@@H]2CCN(CCc3c[nH]c4ccc(-n5cnnc5)cc34)C2)co1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL159759 OBDepict H N N N N N H N H CH 3 H IC50 = 0.45 nM 414.56 C[C@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(-n4cnnc4)cc23)C1)c1ccccc1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL301757 OBDepict H 2 N N H 3 C CH 3 CH 3 CH 3 Ki = 0.45 nM 230.35 Cn1cc(CCN)c2cc(C(C)(C)C)ccc21 Homo sapiens CHEMBL616935 single protein format
CHEMBL129813 OBDepict CH 3 N N O N O N O O Ki = 0.45 nM 502.62 CN1CCN(c2cccc3ccc(OCC(=O)N4CCN(c5cccc6c5OCCO6)CC4)cc23)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL113893 OBDepict CH 3 N H N H N N H O Ki = 0.45 nM 464.61 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(C(=O)Nc4cccc5ccccc45)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL325175 OBDepict CH 3 N H N H N N H O Ki = 0.45 nM 414.55 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(C(=O)Nc4ccccc4)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL357034 OBDepict H 3 C N H N H CH 3 CH 3 CH 3 Ki = 0.45 nM 230.35 CNCCc1c[nH]c2ccc(C(C)(C)C)cc12 Homo sapiens CHEMBL616933 single protein format
CHEMBL113994 OBDepict CH 3 O N H N S N H H N CH 3 Ki = 0.46 nM 460.65 COc1ccc(NC(=S)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL116031 OBDepict F N N N H N N N IC50 = 0.5 nM 432.55 Fc1ccccc1CCN1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL148233 OBDepict CH 3 N N CH 3 CH 3 N H N N N IC50 = 0.5 nM 406.58 CC(C)=CCN(C)C1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616907 cell-based format
CHEMBL161696 OBDepict Cl N N N H N N N IC50 = 0.5 nM 434.98 Clc1ccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL171129 OBDepict CH 3 N H 3 C N H S Ki = 0.5 nM 270.4 CN(C)CCc1c[nH]c2ccc(-c3ccsc3)cc12 Homo sapiens CHEMBL616938 single protein format
CHEMBL2112660 OBDepict N N N O O N N H 3 C Ki = 0.51 nM 469.59 CN1CCN(c2cccc3ccc(OCC(=O)N4CCN(c5ccccc5C#N)CC4)cc23)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL2112662 OBDepict CH 3 N N O N O N CH 3 Ki = 0.55 nM 472.63 Cc1ccccc1CN1CCN(C(=O)COc2ccc3cccc(N4CCN(C)CC4)c3c2)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL472117 OBDepict H N N O F F F N N N N H F F F Ki = 0.55 nM 498.43 FC(F)(F)c1nc2c(N3CCN(CCOc4cccc5nc(C(F)(F)F)[nH]c45)CC3)cccc2[nH]1 Homo sapiens CHEMBL963644 single protein format
CHEMBL115663 OBDepict CH 3 N H N H N N SH Cl Ki = 0.56 nM 465.07 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(/C(S)=N/c4ccc(Cl)cc4)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL121901 OBDepict NH 2 N H O N O N NH S O O CH 3 Ki = 0.56 nM 471.58 CS(=O)(=O)Nc1ccc(N2CCN(C(=O)COc3ccc4[nH]cc(CCN)c4c3)CC2)cc1 Homo sapiens CHEMBL617304 single protein format
CHEMBL332142 OBDepict H 2 N N H O N O N + N O _ O Ki = 0.58 nM 423.47 NCCc1c[nH]c2ccc(OCC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)cc12 Homo sapiens CHEMBL617304 single protein format
CHEMBL162858 OBDepict H N N N N N N N IC50 = 0.6 nM 401.52 c1cc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)ccn1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL159396 OBDepict H N N N N N N N N IC50 = 0.6 nM 388.48 c1cnc(N2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)nc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL292779 OBDepict F N N N H N N N IC50 = 0.6 nM 432.55 Fc1cccc(CCN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616910 cell-based format
CHEMBL148087 OBDepict H N N N N N N H CH 3 H IC50 = 0.6 nM 428.58 C[C@H](NC1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1)c1ccccc1 Homo sapiens CHEMBL616906 cell-based format
CHEMBL420965 OBDepict H N N N N N H N H IC50 = 0.6 nM 400.53 c1ccc(CNC[C@@H]2CCN(CCc3c[nH]c4ccc(-n5cnnc5)cc34)C2)cc1 Homo sapiens CHEMBL616909 cell-based format
CHEMBL147660 OBDepict CH 3 N N N H O CH 3 N H N N N IC50 = 0.6 nM 499.66 CC(=O)Nc1ccc(CN(C)CC2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616907 cell-based format
CHEMBL146483 OBDepict CH 3 N H O N H H 3 C H N N H N N N IC50 = 0.6 nM 499.66 CC(=O)Nc1ccc([C@H](C)NCC2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616907 cell-based format
CHEMBL67684 OBDepict CH 3 F N N H N N N IC50 = 0.6 nM 445.59 CC(CC1(F)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1)c1ccccc1 Homo sapiens CHEMBL616912 cell-based format
CHEMBL444341 OBDepict H 2 N N H CH 3 CH 3 CH 3 Ki = 0.6 nM 216.33 CC(C)(C)c1ccc2[nH]cc(CCN)c2c1 Homo sapiens CHEMBL616933 single protein format
CHEMBL338015 OBDepict CH 3 O O N H 3 C N O O N N H 3 C Ki = 0.62 nM 504.63 COc1cccc(N2CCN(C(=O)COc3ccc4cccc(N5CCN(C)CC5)c4c3)CC2)c1OC Homo sapiens CHEMBL616934 cell-based format
CHEMBL331819 OBDepict H 3 C CH 3 N CH 3 OH N N H N N N IC50 = 0.65 nM 424.59 CC(C)CN(C)CC1(O)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616901 cell-based format
CHEMBL116161 OBDepict H N N N N N OH N H 3 C CH 3 IC50 = 0.65 nM 450.63 CC1(C)CCCN(CC2(O)CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)C1 Homo sapiens CHEMBL616901 cell-based format
CHEMBL334259 OBDepict CH 3 N H N H N N SH Ki = 0.68 nM 430.62 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(/C(S)=N/c4ccccc4)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL340786 OBDepict H 3 C N N O N O N CH 3 Ki = 0.69 nM 458.61 Cc1ccccc1N1CCN(C(=O)COc2ccc3cccc(N4CCN(C)CC4)c3c2)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL347665 OBDepict N N N N H N N N IC50 = 0.7 nM 425.54 N#Cc1ccc(CN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL163386 OBDepict HO N N N H N N N IC50 = 0.7 nM 430.56 OCC(c1ccccc1)N1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL116153 OBDepict F F N N N H N N N IC50 = 0.7 nM 450.54 Fc1cc(F)cc(CCN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616903 cell-based format
CHEMBL348864 OBDepict CH 3 N H 3 C H H N N H N N N IC50 = 0.7 nM 442.61 C[C@@H](c1ccccc1)N(C)C[C@@H]1CCN(CCc2c[nH]c3ccc(Cn4cncn4)cc23)C1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL434125 OBDepict OH N H H N N H N N IC50 = 0.7 nM 443.6 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(-n4ccnc4)cc23)CC1)c1ccccc1 Homo sapiens CHEMBL616907 cell-based format
CHEMBL312448 OBDepict CH 3 CH 3 H 3 C H 3 C CH 3 N H N Ki = 0.7 nM 244.38 Cc1cc(C(C)(C)C)cc(C)c1CC1=NCCN1 Homo sapiens CHEMBL875909 single protein format
CHEMBL117579 OBDepict CH 3 N H N N H N N N IC50 = 0.7 nM 414.56 CN(Cc1ccccc1)C[C@@H]1CCN(CCc2c[nH]c3ccc(-n4cnnc4)cc23)C1 Homo sapiens CHEMBL616904 cell-based format
CHEMBL170192 OBDepict CH 3 N H 3 C N H S Ki = 0.7 nM 270.4 CN(C)CCc1c[nH]c2ccc(-c3cccs3)cc12 Homo sapiens CHEMBL616938 single protein format
CHEMBL85668 OBDepict H N H N N CH 3 H H N N IC50 = 0.7 nM 411.55 CN1[C@@H](Cc2c[nH]c3ccc(-n4ccnc4)cc23)C[C@@H]2CN(Cc3ccccc3)C[C@@H]21 Homo sapiens CHEMBL616900 cell-based format
CHEMBL15928 OBDepict CH 3 O N HN N O CH 3 CH 3 N N O H 3 C Ki = 0.7 nM 497.6 COc1ccc(NC(=O)c2ccc(-c3ccc(-c4noc(C)n4)cc3C)cc2)cc1N1CCN(C)CC1 Homo sapiens CHEMBL616937 single protein format
CHEMBL129661 OBDepict CH 3 O N HN Ki = 0.7 nM 242.32 COc1ccc2ccc(N3CCNCC3)cc2c1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL117397 OBDepict CH 3 N H N H N N SH Ki = 0.7 nM 480.68 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(/C(S)=N/c4cccc5ccccc45)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL161410 OBDepict H N N N N N H N H CH 3 H IC50 = 0.72 nM 414.56 C[C@@H](NC[C@@H]1CCN(CCc2c[nH]c3ccc(-n4cnnc4)cc23)C1)c1ccccc1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL339308 OBDepict CH 3 O N HN N O CH 3 CH 3 NH N O H 3 C Ki = 0.74 nM 499.62 COc1ccc(NC(=O)c2ccc(-c3ccc(C4=NC(C)ON4)cc3C)cc2)cc1N1CCN(C)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL63799 OBDepict F F N N H N N N IC50 = 0.75 nM 449.55 Fc1cccc(CCC2(F)CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)c1 Homo sapiens CHEMBL616910 cell-based format
CHEMBL1185 OBDepict CH 3 N CH 3 N H H NH O O Ki = 0.76 nM 287.36 CN(C)CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12 Homo sapiens CHEMBL616932 single protein format
CHEMBL115941 OBDepict H 3 C O S N O O N H H N H 3 C Ki = 0.76 nM 465.62 COc1ccc(S(=O)(=O)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL159683 OBDepict CH 3 N H N N H N N N IC50 = 0.8 nM 414.56 CN(Cc1ccccc1)C[C@@H]1CCCN1CCc1c[nH]c2ccc(-n3cnnc3)cc12 Homo sapiens CHEMBL616908 cell-based format
CHEMBL82204 OBDepict F N H N H CH 3 H N H N N N IC50 = 0.8 nM 430.53 CN1[C@@H](Cc2c[nH]c3ccc(-n4cnnc4)cc23)C[C@@H]2CN(Cc3ccc(F)cc3)C[C@@H]21 Homo sapiens CHEMBL616900 cell-based format
CHEMBL67460 OBDepict F F N N H N N N IC50 = 0.8 nM 449.55 Fc1ccccc1CCC1(F)CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1 Homo sapiens CHEMBL616912 cell-based format
CHEMBL162722 OBDepict CH 3 N N N H N N N IC50 = 0.8 nM 428.58 CC(CN1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1)c1ccccc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL442 OBDepict H N H N CH 3 H HN O CH 3 O O N OH H N H O Ki = 0.8 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 CHEMBL616927 single protein format
CHEMBL352159 OBDepict S N N N H N N N IC50 = 0.8 nM 430.58 S=C1CN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CCN1Cc1ccccc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL116876 OBDepict CH 3 N H N H N S O O CH 3 Ki = 0.8 nM 449.62 Cc1ccc(S(=O)(=O)N2CC=C(c3ccc4[nH]cc(C[C@H]5CCCN5C)c4c3)CC2)cc1 Homo sapiens CHEMBL616924 single protein format
CHEMBL115750 OBDepict F N N N H N N N IC50 = 0.8 nM 432.55 Fc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1 Homo sapiens CHEMBL616911 cell-based format
CHEMBL348304 OBDepict H N N N H N N O IC50 = 0.81 nM 401.51 c1ccc(COC[C@@H]2CCCN2CCc2c[nH]c3ccc(-n4cnnc4)cc23)cc1 Homo sapiens CHEMBL616908 cell-based format
CHEMBL21862 OBDepict NH 2 O N H HN HN N H O NH 2 IC50 = 0.83 nM 592.79 NC(=O)c1ccc2[nH]cc(C3=CCC(NCCCCCCNC4CC=C(c5c[nH]c6ccc(C(N)=O)cc56)CC4)CC3)c2c1 Homo sapiens CHEMBL616512 single protein format
CHEMBL2112661 OBDepict H 3 C N N O N O N Ki = 0.88 nM 494.64 CN1CCN(c2cccc3ccc(OCC(=O)N4CCN(c5cccc6ccccc56)CC4)cc23)CC1 Homo sapiens CHEMBL616934 cell-based format
CHEMBL323666 OBDepict CH 3 N H N H N S O O Ki = 0.88 nM 485.65 CN1CCC[C@@H]1Cc1c[nH]c2ccc(C3=CCN(S(=O)(=O)c4cccc5ccccc45)CC3)cc12 Homo sapiens CHEMBL616924 single protein format
CHEMBL1788197 OBDepict CH 3 N H N O H Ki = 0.9 nM 374.53 CCCN(CCCc1ccccc1)[C@@H]1CCc2ccc3[nH]cc(C=O)c3c2C1 Homo sapiens CHEMBL617305 cell-based format
CHEMBL84070 OBDepict CH 3 N H N H 3 C H N H N N IC50 = 0.9 nM 413.57 CN(Cc1ccccc1)C[C@H]1C[C@H](Cc2c[nH]c3ccc(-n4ccnc4)cc23)N(C)C1 Homo sapiens CHEMBL616900 cell-based format
CHEMBL313714 OBDepict OH N H H F N N H N N N Ki = 0.9 nM 462.57 OC[C@H](NC1CCN(CCCc2c[nH]c3ccc(-n4cnnc4)cc23)CC1)c1ccc(F)cc1 Homo sapiens CHEMBL616929 cell-based format
CHEMBL119668 OBDepict F F N N N H N N N IC50 = 0.9 nM 450.54 Fc1ccc(CCN2CCN(CCCc3c[nH]c4ccc(-n5cnnc5)cc34)CC2)cc1F Homo sapiens CHEMBL616911 cell-based format
CHEMBL448902 OBDepict H 3 C N N H NH O NH O N H N CH 3 Ki = 0.9 nM 596.82 CN1CCC(c2c[nH]c3ccc(NC(=O)CCCCCCC(=O)Nc4ccc5[nH]cc(C6CCN(C)CC6)c5c4)cc23)CC1 Homo sapiens CHEMBL965238 cell-based format