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Q8IV61 | GRP3_HUMAN | Ras guanyl-releasing protein 3 (RASGRP3)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL519741 OBDepict H 3 C O O CH 3 O HO O N CH 3 Ki = 0.18 nM 413.51 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2cn(C)c3ccccc23)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL530110 OBDepict OH O O O O H 3 C CH 3 H 3 C H 3 C N Ki = 0.2 nM 389.49 CC(C)CC(CC(C)C)C(=O)OCC1(CO)C/C(=Cc2ccccn2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL3289012 OBDepict CH 3 O O H 3 C O HO O N H 3 C Ki = 0.34 nM 413.51 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2ccc3c(ccn3C)c2)C(=O)O1 Homo sapiens CHEMBL3294519 assay format
CHEMBL488872 OBDepict CH 3 O O H 3 C O HO O N Ki = 0.52 nM 411.5 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2cnc3ccccc3c2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4160361 OBDepict OH O O O O H 3 C CH 3 H 3 C Cl Ki = 0.53 nM 352.81 CC(C)(C)C(=O)OCC1(CO)C/C(=Cc2ccc(Cl)cc2)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL488667 OBDepict HO O O O O H 3 C H 3 C CH 3 H 3 C N H 3 C Ki = 0.7 nM 441.57 CC(C)CC(CC(C)C)C(=O)OCC1(CO)C/C(=Cc2cn(C)c3ccccc23)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL472007 OBDepict H 3 C O O CH 3 O OH O N Ki = 0.72 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2ccccn2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4160647 OBDepict OH O O O O H 3 C CH 3 H 3 C N CH 3 Cl Ki = 1.01 nM 405.88 Cn1cc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2cc(Cl)ccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4162516 OBDepict HO O O O O CH 3 CH 3 H 3 C N CH 3 H 3 C Ki = 1.07 nM 361.44 CN(C)c1ccc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4163130 OBDepict HO O O O O CH 3 CH 3 H 3 C O H 3 C Ki = 1.09 nM 348.4 COc1ccc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL3289014 OBDepict H 3 C O O H 3 C O HO O N CH 3 Ki = 1.12 nM 413.51 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2cccc3ccn(C)c23)C(=O)O1 Homo sapiens CHEMBL3294519 assay format
CHEMBL3289013 OBDepict CH 3 O O H 3 C O HO O N CH 3 Ki = 1.22 nM 413.51 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2ccc3ccn(C)c3c2)C(=O)O1 Homo sapiens CHEMBL3294519 assay format
CHEMBL4174397 OBDepict OH O O O O Cl O CH 3 Ki = 1.54 nM 402.83 COc1ccc(/C=C2CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL472522 OBDepict H 3 C O O CH 3 O OH O N Ki = 1.6 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2cccnc2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL3289011 OBDepict H 3 C O O H 3 C O HO O N H 3 C Ki = 1.63 nM 413.51 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2cccc3c2ccn3C)C(=O)O1 Homo sapiens CHEMBL3294519 assay format
CHEMBL4174723 OBDepict HO O O O O CH 3 H 3 C CH 3 S Ki = 1.67 nM 374.46 CC(C)(C)C(=O)OCC1(CO)C/C(=Cc2csc3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL529000 OBDepict CH 3 O O H 3 C O HO O N Ki = 1.7 nM 411.5 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2ccc3ccccc3n2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4169454 OBDepict HO O O O O CH 3 H 3 C CH 3 N H 3 C Ki = 1.75 nM 371.43 Cn1cc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL511820 OBDepict HO O O O O N H 3 C CH 3 + N O _ O Ki = 1.8 nM 426.43 CN(C)c1ccccc1C(=O)OCC1(CO)C/C(=Cc2ccc([N+](=O)[O-])cc2)C(=O)O1 Homo sapiens CHEMBL979907 single protein format
CHEMBL4167589 OBDepict OH O O O O Cl N CH 3 CH 3 Ki = 1.81 nM 415.87 CN(C)c1ccc(/C=C2CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4160540 OBDepict CH 3 N O O HO O O CH 3 CH 3 H 3 C Ki = 1.87 nM 413.51 CCCCn1cc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4161221 OBDepict OH O O O O N H 3 C CH 3 CH 3 H 3 C Ki = 2.15 nM 453.58 Cn1cc(/C=C2CC(CO)(COC(=O)C3CCC(C(C)(C)C)CC3)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL519398 OBDepict HO O O O O + N + N O _ O O _ O Ki = 2.22 nM 428.35 O=C1OC(CO)(COC(=O)c2ccc([N+](=O)[O-])cc2)C/C1=Cc1ccc([N+](=O)[O-])cc1 Homo sapiens CHEMBL979907 single protein format
CHEMBL4175934 OBDepict HO O O O O O Cl H 3 C Ki = 2.25 nM 402.83 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc(Cl)cc3)C(=O)O2)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL471153 OBDepict OH O O O O N CH 3 CH 3 + N O _ O Ki = 2.3 nM 426.43 CN(C)c1cccc(C(=O)OCC2(CO)C/C(=Cc3ccc([N+](=O)[O-])cc3)C(=O)O2)c1 Homo sapiens CHEMBL979907 single protein format
CHEMBL4172461 OBDepict HO O O O O Cl Cl Ki = 2.69 nM 407.25 O=C1OC(CO)(COC(=O)c2ccc(Cl)cc2)C/C1=Cc1ccc(Cl)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4175128 OBDepict HO O O O O N Cl CH 3 H 3 C Ki = 2.73 nM 415.87 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc(Cl)cc3)C(=O)O2)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4165117 OBDepict HO O O O O CH 3 H 3 C CH 3 O Ki = 2.8 nM 358.39 CC(C)(C)C(=O)OCC1(CO)C/C(=Cc2coc3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4163809 OBDepict OH O O O O N H 3 C Ki = 2.86 nM 397.47 Cn1cc(/C=C2CC(CO)(COC(=O)C3CCCCC3)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4167900 OBDepict OH O O O O H 3 C CH 3 H 3 C N H 3 C CH 3 Ki = 3.03 nM 413.51 CC(C)Cn1cc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL488674 OBDepict OH O O O O N H 3 C O CH 3 Ki = 3.3 nM 421.45 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3cn(C)c4ccccc34)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4175761 OBDepict OH O O O O CH 3 CH 3 H 3 C N Ki = 3.58 nM 411.5 CC(C)(C)C(=O)OCC1(CO)C/C(=Cc2cn(CC3CC3)c3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL472521 OBDepict OH O O O O N H 3 C N H 3 C CH 3 Ki = 3.7 nM 434.49 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3cn(C)c4ccccc34)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL488675 OBDepict HO O O O O N + N CH 3 H 3 C O _ O Ki = 3.8 nM 426.43 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1 Homo sapiens CHEMBL979907 single protein format
CHEMBL472002 OBDepict OH O O O O N CH 3 H 3 C + N O _ O Ki = 3.9 nM 426.43 CN(C)c1ccccc1C(=O)OCC1(CO)C/C(=Cc2cccc([N+](=O)[O-])c2)C(=O)O1 Homo sapiens CHEMBL979907 single protein format
CHEMBL461754 OBDepict H 3 C O O O OH O O O CH 3 Ki = 4.17 nM 398.41 COc1ccc(/C=C2CC(CO)(COC(=O)c3ccc(OC)cc3)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4175333 OBDepict HO O O O O CH 3 H 3 C CH 3 S Ki = 4.26 nM 374.46 CC(C)(C)C(=O)OCC1(CO)C/C(=C/c2csc3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4161062 OBDepict OH O O O O H 3 C CH 3 H 3 C N CH 3 Cl Ki = 4.32 nM 405.88 Cn1cc(/C=C2/CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2cc(Cl)ccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL488871 OBDepict CH 3 O O H 3 C O HO O N Ki = 4.6 nM 411.5 CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2ccc3ccccc3n2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL452307 OBDepict OH O O O O N N CH 3 CH 3 H 3 C H 3 C Ki = 4.68 nM 424.5 CN(C)c1ccc(/C=C2CC(CO)(COC(=O)c3ccc(N(C)C)cc3)OC2=O)cc1 Homo sapiens CHEMBL979907 single protein format
CHEMBL4171253 OBDepict HO O O O O H 3 C H 3 C CH 3 N H 3 C O CH 3 Ki = 4.76 nM 401.46 COc1ccc2c(c1)c(/C=C1CC(CO)(COC(=O)C(C)(C)C)OC1=O)cn2C Homo sapiens CHEMBL4137136 assay format
CHEMBL472001 OBDepict OH O O O O N + N CH 3 CH 3 O _ O Ki = 5.3 nM 426.43 CN(C)c1cccc(C(=O)OCC2(CO)C/C(=Cc3cccc([N+](=O)[O-])c3)C(=O)O2)c1 Homo sapiens CHEMBL979907 single protein format
CHEMBL4167264 OBDepict CH 3 O O O OH O N H 3 C Ki = 5.3 nM 399.49 CCCCCCC(=O)OCC1(CO)C/C(=Cc2cn(C)c3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL488668 OBDepict CH 3 O O O O OH O + N O _ O Ki = 6.7 nM 413.38 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL461374 OBDepict CH 3 O O O OH O O N CH 3 H 3 C Ki = 7.0 nM 411.45 COc1ccc(/C=C2CC(CO)(COC(=O)c3ccc(N(C)C)cc3)OC2=O)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL4167457 OBDepict HO O O O O CH 3 H 3 C CH 3 N N H 3 C Ki = 7.22 nM 372.42 Cn1nc(/C=C2CC(CO)(COC(=O)C(C)(C)C)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL508870 OBDepict CH 3 O O O O OH O N H 3 C CH 3 Ki = 7.48 nM 411.45 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc(N(C)C)cc3)C(=O)O2)cc1 Homo sapiens CHEMBL4137136 assay format
CHEMBL472171 OBDepict OH O O O O + N N O _ O H 3 C CH 3 Ki = 8.0 nM 426.43 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3cccc([N+](=O)[O-])c3)C(=O)O2)cc1 Homo sapiens CHEMBL979907 single protein format
CHEMBL487473 OBDepict H 3 C O O O O HO O N Ki = 8.2 nM 419.43 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc4ccccc4n3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL471317 OBDepict OH O O O O N + N CH 3 H 3 C O _ O Ki = 9.4 nM 426.43 CN(C)c1ccccc1C(=O)OCC1(CO)C/C(=Cc2ccccc2[N+](=O)[O-])C(=O)O1 Homo sapiens CHEMBL979907 single protein format
CHEMBL511472 OBDepict HO O O O O N N CH 3 H 3 C Ki = 11.0 nM 432.48 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccc4ccccc4n3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4168968 OBDepict OH O O O O N H 3 C Cl Ki = 11.2 nM 425.87 Cn1cc(/C=C2CC(CO)(COC(=O)c3ccc(Cl)cc3)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4164402 OBDepict HO O O O O CH 3 H 3 C CH 3 O Ki = 11.67 nM 358.39 CC(C)(C)C(=O)OCC1(CO)C/C(=C/c2coc3ccccc23)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL472523 OBDepict H 3 C O O CH 3 O OH O N Ki = 13.8 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=Cc2ccncc2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL472174 OBDepict OH O O O O + N O _ O N H 3 C CH 3 Ki = 14.4 nM 426.43 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccccc3[N+](=O)[O-])C(=O)O2)cc1 Homo sapiens CHEMBL979907 single protein format
CHEMBL339911 OBDepict HO H CH 3 OH CH 3 OH O CH 3 H H 3 C H 3 C CH 3 H CH 3 Ki = 15.5 nM 486.74 CC1=CC[C@H](C)C(C)(C)[C@@H]1/C=C/C(C)=CCC[C@@]1(CO)[C@H](CCCO)/C(=C(/C)C=O)CC[C@]1(C)O Homo sapiens CHEMBL771810 single protein format
CHEMBL4170226 OBDepict HO O O O O N H 3 C N H 3 C Ki = 15.7 nM 470.53 Cn1cc(/C=C/C(=O)OCC2(CO)C/C(=Cc3cn(C)c4ccccc34)C(=O)O2)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL513069 OBDepict HO O O O O + N N O _ O CH 3 H 3 C Ki = 16.4 nM 426.43 CN(C)c1cccc(C(=O)OCC2(CO)C/C(=Cc3ccccc3[N+](=O)[O-])C(=O)O2)c1 Homo sapiens CHEMBL979907 single protein format
CHEMBL488509 OBDepict OH O O O O N O CH 3 Ki = 17.4 nM 419.43 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3cnc4ccccc4c3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL487483 OBDepict OH O O O O N N H 3 C CH 3 Ki = 23.8 nM 382.42 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccccn3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4160009 OBDepict OH O O O O N CH 3 Ki = 25.0 nM 417.46 Cn1cc(/C=C2CC(CO)(COC(=O)/C=C/c3ccccc3)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4175742 OBDepict HO O O O O N Cl Ki = 29.0 nM 373.79 O=C1OC(CO)(COC(=O)c2ccc(Cl)cc2)C/C1=Cc1ccccn1 Homo sapiens CHEMBL4137136 assay format
CHEMBL488707 OBDepict CH 3 O O H 3 C O HO O N Ki = 32.2 nM 411.5 CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2cnc3ccccc3c2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL470094 OBDepict HO O O O O N O H 3 C Ki = 35.8 nM 369.37 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccccn3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL123519 OBDepict OH H CH 3 H 3 C HO H HO O H H 2 C O O H 3 C H 3 C H 3 C Ki = 41.7 nM 528.73 C=C(/C=C/C=C(/CCC=C(C)C)COC(C)=O)[C@@H]1CC[C@]2([C@H](CCCO)/C(=C(/C)C=O)CC[C@]2(C)O)[C@@H]1O Homo sapiens CHEMBL771809 single protein format
CHEMBL443643 OBDepict H 3 C O O CH 3 O OH O N Ki = 44.0 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2ccncc2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL488670 OBDepict OH O O O O N N H 3 C CH 3 Ki = 54.0 nM 382.42 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3ccncc3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL487822 OBDepict HO O O O O N O H 3 C Ki = 54.2 nM 369.37 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3ccncc3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL487484 OBDepict OH O O O O N N H 3 C CH 3 Ki = 59.0 nM 382.42 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3cccnc3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL471316 OBDepict HO O O O O N O H 3 C Ki = 81.0 nM 369.37 COc1ccc(C(=O)OCC2(CO)C/C(=Cc3cccnc3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL512538 OBDepict H 3 C O O CH 3 O OH O N Ki = 83.0 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2ccccn2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL472183 OBDepict HO O O O O N N CH 3 H 3 C Ki = 137.0 nM 432.48 CN(C)c1ccc(C(=O)OCC2(CO)C/C(=Cc3cnc4ccccc4c3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL4170651 OBDepict OH O O O O N N CH 3 Ki = 149.0 nM 418.45 Cn1cc(/C=C2CC(CO)(COC(=O)/C=C/c3ccccn3)OC2=O)c2ccccc21 Homo sapiens CHEMBL4137136 assay format
CHEMBL4173300 OBDepict OH O O O O H 3 C CH 3 H 3 C N Ki = 192.0 nM 319.36 CC(C)(C)C(=O)OCC1(CO)C/C(=Cc2ccccn2)C(=O)O1 Homo sapiens CHEMBL4137136 assay format
CHEMBL511847 OBDepict H 3 C O O CH 3 O OH O N Ki = 670.0 nM 361.44 CCCC(CCC)C(=O)OCC1(CO)C/C(=C/c2cccnc2)C(=O)O1 Homo sapiens CHEMBL977319 cell-based format
CHEMBL528323 OBDepict OH O O O O N O CH 3 Ki = 907.0 nM 419.43 COc1ccc(C(=O)OCC2(CO)C/C(=C/c3cnc4ccccc4c3)C(=O)O2)cc1 Homo sapiens CHEMBL977319 cell-based format