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Q9HCG7 | GBA2_HUMAN | Non-lysosomal glucosylceramidase (GBA2)

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
CHEMBL3354625 OBDepict OH H N H OH H HO H HO O F IC50 = 0.08 nM 433.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(F)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354624 OBDepict HO H N H HO H OH H OH O F IC50 = 0.08 nM 433.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1F Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354627 OBDepict OH H N H OH H HO H HO O F F F IC50 = 0.08 nM 483.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(C(F)(F)F)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354635 OBDepict OH H N H OH H HO H HO O F F F IC50 = 0.1 nM 483.53 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(C(F)(F)F)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354634 OBDepict OH H N H OH H OH H OH O F F F IC50 = 0.1 nM 483.53 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1C(F)(F)F Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354626 OBDepict OH H N H OH H OH H OH O F F F IC50 = 0.12 nM 483.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1C(F)(F)F Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354636 OBDepict HO H N H HO H OH H OH O F IC50 = 0.4 nM 433.52 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1F Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354041 OBDepict OH H N H HO H HO H OH O CH 3 IC50 = 0.5 nM 429.56 Cc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354637 OBDepict OH H N H OH H HO H HO O F IC50 = 0.6 nM 433.52 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(F)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354019 OBDepict HO H N H HO H OH H OH O IC50 = 1.0 nM 397.56 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1C2CC3CC(C2)CC1C3 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354021 OBDepict OH H N H OH H HO H HO O IC50 = 1.0 nM 339.43 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354022 OBDepict OH H N H OH H HO H HO O IC50 = 1.0 nM 389.49 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccccc2c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354035 OBDepict OH H N H OH H HO H HO O IC50 = 1.0 nM 389.49 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccccc2c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354629 OBDepict OH H N H HO H HO H OH O CH 3 H IC50 = 1.0 nM 429.56 C[C@@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354037 OBDepict HO H N H HO H HO H HO O IC50 = 1.0 nM 463.57 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccc3cccc4ccc1c2c34 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354048 OBDepict OH H N H OH H HO H HO O F IC50 = 1.0 nM 433.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(F)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354049 OBDepict OH H N H OH H HO H HO O F IC50 = 1.0 nM 433.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cccc(F)c2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL574645 OBDepict OH H N H OH H OH H HO O IC50 = 1.0 nM 397.56 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL1040323 single protein format
CHEMBL3354621 OBDepict OH H N H OH H HO H HO F F O IC50 = 1.0 nM 451.51 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC(F)(F)COCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL4459011 OBDepict CH 3 O N OH HO HO HO IC50 = 1.0 nM 333.47 CCCCCCOCCCCCN1CC(O)C(O)C(O)C1CO Homo sapiens CHEMBL4395493 cell-based format
CHEMBL1088158 OBDepict OH H N H OH H OH H HO O IC50 = 1.0 nM 397.56 OC[C@@H]1[C@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354046 OBDepict N O N H H HO HO H HO H HO IC50 = 2.0 nM 440.54 N#Cc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354633 OBDepict OH H N H OH H HO H HO F F O IC50 = 2.0 nM 451.51 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC(F)(F)COCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354016 OBDepict OH H N H OH H OH H HO O IC50 = 2.0 nM 411.58 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354063 OBDepict OH H N H OH H HO H HO O IC50 = 2.0 nM 415.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354632 OBDepict HO H N H HO H OH F F O H OH IC50 = 2.0 nM 451.51 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CC(F)(F)CCCOCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354054 OBDepict HO H N H OH H HO H HO O O O IC50 = 2.0 nM 459.54 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCO3)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354051 OBDepict OH H N H OH H HO H HO O Cl IC50 = 2.0 nM 449.98 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(Cl)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354631 OBDepict OH H N H OH H HO H HO O IC50 = 2.0 nM 415.53 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1cccc(-c2ccccc2)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354050 OBDepict HO H N H HO H OH H OH O F IC50 = 2.0 nM 433.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2F)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354032 OBDepict HO H N H HO H OH H OH O IC50 = 2.0 nM 397.56 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1C2CC3CC(C2)CC1C3 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354040 OBDepict OH H N H HO H HO H OH O CH 3 IC50 = 2.0 nM 429.56 Cc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354025 OBDepict OH H N H OH H HO H HO O IC50 = 2.0 nM 415.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354628 OBDepict OH H N H HO H HO H OH O CH 3 H IC50 = 2.0 nM 429.56 C[C@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL450985 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 2.0 nM 331.5 CCCCCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL971353 assay format
CHEMBL3354638 OBDepict OH H N H OH H HO H HO O IC50 = 2.0 nM 415.53 OC[C@@H]1[C@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354029 OBDepict OH H N H OH H OH H HO O IC50 = 2.5 nM 411.58 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354045 OBDepict N O N H H OH HO H HO H HO IC50 = 3.0 nM 440.54 N#Cc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354044 OBDepict CH 3 O O N H H OH OH H OH H OH IC50 = 3.0 nM 445.56 COc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354062 OBDepict HO H N H HO H OH H OH O IC50 = 3.0 nM 415.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1-c1ccccc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354039 OBDepict OH H N H HO H HO H OH O CH 3 IC50 = 3.0 nM 429.56 Cc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354038 OBDepict OH H N H OH H HO H HO O IC50 = 3.0 nM 415.53 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354064 OBDepict OH H N H OH H HO H HO O N IC50 = 3.0 nM 416.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cn1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354034 OBDepict OH H N H OH H HO H HO O IC50 = 3.0 nM 339.43 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354024 OBDepict HO H N H HO H HO H HO O IC50 = 3.0 nM 463.57 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccc3cccc4ccc1c2c34 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354630 OBDepict HO H N H HO H OH H OH O IC50 = 3.0 nM 415.53 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1-c1ccccc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354623 OBDepict OH H N H HO H HO H OH O CH 3 H IC50 = 3.0 nM 429.56 C[C@@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354622 OBDepict OH H N H HO H HO H OH O CH 3 H IC50 = 3.0 nM 429.56 C[C@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)c1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL4559665 OBDepict HO N HO OH OH O IC50 = 4.0 nM 397.56 OCC1C(O)C(O)C(O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL4395493 cell-based format
CHEMBL3354014 OBDepict OH H N H OH H HO H HO O IC50 = 4.0 nM 345.48 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1CCCCC1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354060 OBDepict OH H N H OH H HO H HO O N F IC50 = 4.0 nM 434.51 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccnc(F)c2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354047 OBDepict N O N H H HO HO H HO H HO IC50 = 5.0 nM 440.54 N#Cc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354061 OBDepict HO H N H HO H OH H OH O N F IC50 = 5.0 nM 434.51 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(F)nc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354015 OBDepict OH H N H HO H OH H OH IC50 = 5.0 nM 379.54 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC/C=CC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354026 OBDepict OH H N H OH H HO H HO O IC50 = 6.0 nM 345.48 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1CCCCC1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL408500 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 7.0 nM 289.42 CCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354028 OBDepict OH H N H HO H OH H OH IC50 = 8.0 nM 379.54 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC/C=CC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651630 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 8.0 nM 333.47 CCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL2170199 OBDepict HO H N H OH H OH H OH N H O IC50 = 9.0 nM 410.56 O=C(CCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)NC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354042 OBDepict CH 3 O O N H H OH HO H HO H HO IC50 = 10.0 nM 445.56 COc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651627 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 10.0 nM 289.42 CCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354052 OBDepict OH H N H OH H HO H HO O F F F IC50 = 10.0 nM 483.53 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(C(F)(F)F)cc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354058 OBDepict OH H N H OH H HO H HO O N IC50 = 10.0 nM 416.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cccnc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354620 OBDepict HO H N H HO H OH F F O H OH IC50 = 10.0 nM 451.51 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CC(F)(F)CCCOCc1ccc(-c2ccccc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354057 OBDepict OH H N H OH H HO H HO O N IC50 = 10.0 nM 416.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccncc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354017 OBDepict OH H N H HO H OH H OH IC50 = 10.0 nM 381.56 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651632 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 10.0 nM 361.52 CCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651637 OBDepict H 3 C O N H H HO OH H OH H HO IC50 = 15.0 nM 347.5 CCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651638 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 15.0 nM 361.52 CCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354056 OBDepict HO H N H HO H OH H OH O O O IC50 = 15.0 nM 487.59 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCCCO3)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651631 OBDepict H 3 C O N H H HO OH H OH H HO IC50 = 15.0 nM 347.5 CCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354053 OBDepict OH H N H OH H HO H HO O F F F F F F IC50 = 15.0 nM 551.52 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354027 OBDepict HO H N H OH H OH H OH N H O IC50 = 15.0 nM 410.56 O=C(CCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)NC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651635 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 15.0 nM 319.44 CCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL590070 OBDepict CH O O N H O N H H HO HO H HO H HO IC50 = 20.0 nM 482.53 C#CCOc1ccc(C(=O)c2ccc(C(=O)NCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 Homo sapiens CHEMBL1070064 single protein format
CHEMBL3354043 OBDepict H 3 C O O N H H HO OH H OH H OH IC50 = 20.0 nM 445.56 COc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL485840 OBDepict CH 3 O N O H H OH HO H HO H OH IC50 = 20.0 nM 333.43 CCCCCCCCCOC(=O)N1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL971353 assay format
CHEMBL206468 OBDepict OH H N H H HO H HO IC50 = 20.0 nM 147.17 OC[C@H]1CNC[C@@H](O)[C@@H]1O Homo sapiens CHEMBL4276022 assay format
CHEMBL1651552 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 20.0 nM 275.39 CCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651626 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 20.0 nM 275.39 CCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354030 OBDepict OH H N H HO H OH H OH IC50 = 20.0 nM 381.56 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354059 OBDepict OH H N H OH H HO H HO O N N IC50 = 25.0 nM 417.51 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cncnc2)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL1651636 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 25.0 nM 333.47 CCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354055 OBDepict OH H N H OH H HO H HO O O O IC50 = 30.0 nM 473.57 OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCCO3)cc1 Homo sapiens CHEMBL3384691 single protein format
CHEMBL2011641 OBDepict H OH N H OH H OH H CH 3 O IC50 = 30.0 nM 381.56 C[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL2015864 single protein format
CHEMBL1086996 OBDepict OH H N H OH H OH H HO O IC50 = 30.0 nM 397.56 OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL1656919 single protein format
CHEMBL187158 OBDepict CH 3 N OH HO HO HO IC50 = 35.0 nM 289.42 CCCCCCCCCN1CC(O)C(O)C(O)C1CO Homo sapiens CHEMBL4395493 cell-based format
CHEMBL4288931 OBDepict H 3 C H HN H OH H OH H HO IC50 = 40.0 nM 273.42 CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO Homo sapiens CHEMBL4276022 assay format
CHEMBL1651629 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 40.0 nM 319.44 CCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651555 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 40.0 nM 261.36 CCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651633 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 40.0 nM 375.55 CCCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL4577406 OBDepict CH 3 O N OH HO HO HO IC50 = 44.0 nM 375.55 CCCCCCCCCOCCCCCN1CC(O)C(O)C(O)C1CO Homo sapiens CHEMBL4395493 cell-based format
CHEMBL1651551 OBDepict CH 3 N H H OH HO H HO H HO IC50 = 45.0 nM 261.36 CCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651639 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 45.0 nM 375.55 CCCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL1651628 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 60.0 nM 305.42 CCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL4435506 OBDepict OH H N H OH H OH H HO O IC50 = 65.0 nM 397.56 OC[C@H]1[C@H](O)[C@@H](O)[C@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 Homo sapiens CHEMBL4395493 cell-based format
CHEMBL589341 OBDepict CH O O NH O N H H OH HO H HO H HO IC50 = 75.0 nM 434.49 C#CCOc1ccc(C(=O)CCC(=O)NCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 Homo sapiens CHEMBL1070064 single protein format
CHEMBL1651634 OBDepict CH 3 O N H H OH HO H HO H HO IC50 = 90.0 nM 305.42 CCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL1656919 single protein format
CHEMBL3354020 OBDepict HO H N H OH H OH H OH O H 3 C H 3 C CH 3 H 3 C IC50 = 100.0 nM 467.69 CC(C)=CCC/C(C)=C/CC/C(C)=C/CCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO Homo sapiens CHEMBL3384691 single protein format
CHEMBL3354033 OBDepict HO H N H OH H OH H OH O H 3 C H 3 C CH 3 H 3 C IC50 = 100.0 nM 467.69 CC(C)=CCC/C(C)=C/CC/C(C)=C/CCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO Homo sapiens CHEMBL3384691 single protein format