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P35498 | SCN1A_HUMAN | Sodium channel protein type 1 subunit alpha (SCN1A)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL501134 OBDepict HN N H HN H N H NH OH HO O NH O H 2 N IC50 = 2.3 nM 299.29 N=C1N[C@H]2[C@H](COC(N)=O)NC(=N)N3CCC(O)(O)[C@]23N1 Homo sapiens CHEMBL4321991 cell-based format
CHEMBL507974 OBDepict HO OH H O H O H OH H OH N H H OH N H OH H 2 N IC50 = 4.1 nM 319.27 NC1=N[C@H](O)[C@H]2[C@H]3O[C@]4(O)O[C@@H]([C@@H](O)[C@@]2(N1)[C@@H]4O)[C@]3(O)CO Homo sapiens CHEMBL4321991 cell-based format
CHEMBL3662190 OBDepict O N H S F O O O H 3 C IC50 = 6.0 nM 435.56 CC1(COc2cc(F)c(C(=O)NS(=O)(=O)C3CC3)cc2C2CC2)CCC2(CC1)CC2 Homo sapiens CHEMBL4321991 cell-based format
CHEMBL3657855 OBDepict F O N H O S N O O IC50 = 11.0 nM 462.59 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL4321991 cell-based format
CHEMBL4293085 OBDepict O N H F S HN O O N S N Cl O F F F IC50 = 12.0 nM 510.88 O=C(NCc1ccc(OC(F)(F)F)c(Cl)c1)c1ccc(S(=O)(=O)Nc2ncns2)c(F)c1 Homo sapiens CHEMBL4257700 single protein format
CHEMBL4276884 OBDepict O N H F S HN O O N S Cl O F F F IC50 = 20.0 nM 509.89 O=C(NCc1ccc(OC(F)(F)F)c(Cl)c1)c1ccc(S(=O)(=O)Nc2nccs2)c(F)c1 Homo sapiens CHEMBL4257700 single protein format
CHEMBL3617053 OBDepict O N H S NH O O N S IC50 = 32.0 nM 449.56 O=C(Nc1ccc(S(=O)(=O)Nc2nccs2)cc1)C(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL4257700 single protein format
CHEMBL4290579 OBDepict O S N H O N N N O IC50 = 45.0 nM 442.59 O=S(=O)(Nc1nnc2cc(OCC34CC5CC(CC(C5)C3)C4)c(C3CC3)cn12)C1CC1 Homo sapiens CHEMBL4256589 cell-based format
CHEMBL4279238 OBDepict H 3 C S HN O O N N N O IC50 = 53.0 nM 416.55 CS(=O)(=O)Nc1nnc2cc(OCC34CC5CC(CC(C5)C3)C4)c(C3CC3)cn12 Homo sapiens CHEMBL4256589 cell-based format
CHEMBL4285790 OBDepict Cl O Cl N N N N H S O O CH 3 IC50 = 112.0 nM 427.31 CS(=O)(=O)Nc1nnc2cc(COc3cc(Cl)cc(Cl)c3)c(C3CC3)cn12 Homo sapiens CHEMBL4256589 cell-based format
CHEMBL3809595 OBDepict F O F F N N N F F F IC50 = 400.0 nM 347.22 FC(F)(F)Oc1ccc(-c2ccc3nnc(C(F)(F)F)n3c2)cc1 Homo sapiens CHEMBL3813476 assay format
CHEMBL4276813 OBDepict Cl O O F F F S HN O O N S N IC50 = 455.0 nM 465.86 O=S(=O)(Nc1ncns1)c1ccc(OCc2ccc(OC(F)(F)F)c(Cl)c2)cc1 Homo sapiens CHEMBL4257700 single protein format
CHEMBL4854735 OBDepict F N HN S O O F F O H H N F F F F F IC50 = 620.0 nM 581.49 O=S(=O)(Nc1cccc(F)n1)c1cc(F)c(O[C@H]2CCN(CC(F)(F)F)C[C@@H]2c2ccc(F)c(F)c2)c(F)c1 Homo sapiens CHEMBL4813114 single protein format
CHEMBL3632641 OBDepict OH N O N O O IC50 = 670.0 nM 470.57 O=C(c1ccccc1)c1ccc(OCC(O)CN2CCC(N3Cc4ccccc4C3=O)CC2)cc1 Homo sapiens CHEMBL3636865 single protein format
CHEMBL3632696 OBDepict OH N O HN O F F F IC50 = 800.0 nM 422.45 O=C(NC1CCN(CC(O)COc2ccc(C(F)(F)F)cc2)CC1)c1ccccc1 Homo sapiens CHEMBL3636865 single protein format
CHEMBL2325014 OBDepict Cl O N NH 2 N H Cl F S NH O O N S IC50 = 850.0 nM 500.36 Nc1[nH]ncc1-c1cc(Cl)ccc1Oc1cc(F)c(S(=O)(=O)Nc2cscn2)cc1Cl Homo sapiens CHEMBL4321991 cell-based format
CHEMBL3632693 OBDepict H 3 C O O F F F HO N N O IC50 = 910.0 nM 464.48 COc1cc(C(F)(F)F)ccc1OCC(O)CN1CCC(N2Cc3ccccc3C2=O)CC1 Homo sapiens CHEMBL3636865 single protein format
CHEMBL3634332 OBDepict OH N O N O O IC50 = 920.0 nM 470.57 O=C(c1ccccc1)c1cccc(OCC(O)CN2CCC(N3Cc4ccccc4C3=O)CC2)c1 Homo sapiens CHEMBL3636865 single protein format