P31153 | METK2_HUMAN | S-adenosylmethionine synthase isoform type-2 (MAT2A)

Pfam Domain Table

AccessionDomainRangeColor
PF00438S-AdoMet_synt_N - S-adenosylmethionine synthetase, N-terminal domain18~115
PF02772S-AdoMet_synt_M - S-adenosylmethionine synthetase, central domain130~250
PF02773S-AdoMet_synt_C - S-adenosylmethionine synthetase, C-terminal domain252~388

3D structures mapped by conservation among orthologs

[ Domain: "S-adenosylmethionine synthetase" // S-AdoMet_synt_C ]

 PyMOL session

[ Domain: "S-adenosylmethionine synthetase" // S-AdoMet_synt_M ]

 PyMOL session

[ Domain: "S-adenosylmethionine synthetase" // S-AdoMet_synt_N ]

 PyMOL session


[ Alpha Fold Model ] (go)



Known binders annotated in ChEMBL

 IC50 CSV
Only the first 20 rows are shown.
molecule_chembl_idstructureassay_typerelation valueunitmol_wtsmilesorganism assay_chembl_idbao_label
CHEMBL4521249 IC50 = 4.0 nM 499.58 O=c1c(-c2ccc3ncccc3c2)c(Nc2cc[nH]n2)[nH]c2c(C3=CCCCC3)c(-c3ccccc3)nn12 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4552959 IC50 = 4.0 nM 569.58 CCOC(=O)c1nnc(Nc2[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c(=O)c2-c2ccc3ncccc3c2)o1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL5199008 IC50 = 4.7 nM 578.62 CCOc1ncc2cc(C3=CC4N=C(CCN5CCC(O)C5)N(C)C4C=C3)c(=O)n(-c3ccc(OC(F)F)cc3)c2n1 Homo sapiens CHEMBL5141069 single protein format
CHEMBL4558617 IC50 = 5.0 nM 478.56 COc1ccc(-c2c(Nc3cc[nH]n3)[nH]c3c(C4=CCCCC4)c(-c4ccccc4)nn3c2=O)cc1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4514699 IC50 = 7.0 nM 460.5 O=c1c(-c2ccc(O)cc2)c(Nc2cc[nH]n2)[nH]c2c(-c3ccccc3)c(-c3ccccc3)nn12 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4568226 IC50 = 7.0 nM 485.55 COc1ccc(-c2c(Nc3ccccn3)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4582312 IC50 = 7.0 nM 495.55 O=c1c(-c2ccc3ncccc3c2)c(Nc2cc[nH]n2)[nH]c2c(-c3ccccc3)c(-c3ccccc3)nn12 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4860456 IC50 = 8.0 nM 239.28 Cc1cc(=O)n2nc(C)c(-c3ccccc3)c2[nH]1 Homo sapiens CHEMBL5141066 cell-based format
CHEMBL4870597 IC50 = 8.0 nM 428.49 Cc1[nH]c2c(N3CCCCC3)c(-c3ccccc3)nn2c(=O)c1-c1ccc2c(c1)OCO2 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL5185760 IC50 = 10.0 nM 429.91 CCNc1ccc2cn(-c3ccc4nn(C)cc4c3)c(=O)c(-c3ccc(Cl)cc3)c2n1 Homo sapiens CHEMBL5161737 cell-based format
CHEMBL4585665 IC50 = 10.0 nM 479.54 COc1ccc(-c2c(Nc3ccon3)[nH]c3c(C4=CCCCC4)c(-c4ccccc4)nn3c2=O)cc1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL4584451 IC50 = 11.0 nM 546.59 CCOC(=O)n1ccc(Nc2[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c(=O)c2-c2ccc(OC)cc2)n1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL5177250 IC50 = 11.0 nM 483.88 Cn1cc2cc(-n3cc4ccc(NCC(F)(F)F)nc4c(-c4ccc(Cl)cc4)c3=O)ccc2n1 Homo sapiens CHEMBL5161737 cell-based format
CHEMBL5187048 IC50 = 13.0 nM 466.88 Cn1cc2cc(-n3cc4ccc(OCC(F)F)nc4c(-c4ccc(Cl)cc4)c3=O)ccc2n1 Homo sapiens CHEMBL5161737 cell-based format
CHEMBL4559088 IC50 = 13.0 nM 474.52 COc1ccc(-c2c(Nc3cc[nH]n3)[nH]c3c(-c4ccccc4)c(-c4ccccc4)nn3c2=O)cc1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL5078281 IC50 = 13.0 nM 313.79 CCN(C)c1nc(=O)n(-c2ccccc2)c2cc(Cl)ccc12 Homo sapiens CHEMBL5036615 assay format
CHEMBL5399738 IC50 = 14.0 nM 514.54 CN1CCn2c(nc3ccc(-c4cc5cnc(C6CC6)nc5n(-c5ccc(OC(F)F)cc5)c4=O)cc32)C1 Homo sapiens CHEMBL5383988 cell-based format
CHEMBL4573938 IC50 = 14.0 nM 489.58 COc1ccc(-c2c(Nc3ccccn3)[nH]c3c(C4=CCCCC4)c(-c4ccccc4)nn3c2=O)cc1 Homo sapiens CHEMBL4835540 cell-based format
CHEMBL5178902 IC50 = 14.0 nM 484.87 Cn1cc2cc(-n3cc4cnc(NCC(F)(F)F)nc4c(-c4ccc(Cl)cc4)c3=O)ccc2n1 Homo sapiens CHEMBL5161737 cell-based format
CHEMBL5415073 IC50 = 14.0 nM 517.54 CCNc1ncc2cc(-c3ccc4nc5n(c4c3)CCN(C)C5)c(=O)n(-c3ccc(OC(F)F)cc3)c2n1 Homo sapiens CHEMBL5383988 cell-based format