P22303 | ACES_HUMAN | Acetylcholinesterase (ACHE)

Pfam Domain Table

AccessionDomainRangeColor
PF00135COesterase - Carboxylesterase family39~563
PF08674AChE_tetra - Acetylcholinesterase tetramerisation domain578~611

3D structures mapped by conservation among orthologs

[ Domain: "alpha/beta-Hydrolases" // COesterase ]

 PyMOL session


[ Alpha Fold Model ] (go)



Known binders annotated in ChEMBL

 IC50 CSV    Ki CSV
Only the first 20 rows are shown.
molecule_chembl_idstructureassay_typerelation valueunitmol_wtsmilesorganism assay_chembl_idbao_label
CHEMBL4579667 IC50 = 5e-06 nM 498.67 O=C(CCCCCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccc(O)cc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4469239 IC50 = 5e-06 nM 470.69 S=C(CCCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL200008 IC50 = 5e-06 nM 519.09 COc1ccc2[nH]cc(CCNC(=O)CCCCCNc3c4c(nc5cccc(Cl)c35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4467284 IC50 = 5e-06 nM 498.74 S=C(CCCCCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL199748 IC50 = 5e-06 nM 519.09 COc1ccc2[nH]cc(CCNC(=O)CCCCCNc3c4c(nc5cc(Cl)ccc35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4532770 IC50 = 5e-06 nM 512.7 COc1ccc2[nH]cc(CCNC(=O)CCCCCCCNc3c4c(nc5ccccc35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL199454 IC50 = 5e-06 nM 484.64 COc1ccc2[nH]cc(CCNC(=O)CCCCCNc3c4c(nc5ccccc35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4455677 IC50 = 5e-06 nM 470.62 COc1ccc2[nH]cc(CCNC(=O)CCCCNc3c4c(nc5ccccc35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4543251 IC50 = 5e-06 nM 472.61 O=C(CCCCCNc1c2c(nc3ccc(F)cc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4590945 IC50 = 5e-06 nM 551.56 O=C(CCCCCCCNc1c2c(nc3cc(Cl)cc(Cl)c13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL199538 IC50 = 5e-06 nM 523.51 O=C(CCCCCNc1c2c(nc3cc(Cl)cc(Cl)c13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4448350 IC50 = 5e-06 nM 489.06 O=C(CCCCCNc1c2c(nc3c(Cl)cccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL383663 IC50 = 5e-06 nM 489.06 O=C(CCCCCNc1c2c(nc3cc(Cl)ccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4556734 IC50 = 5e-06 nM 482.67 O=C(CCCCCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL199861 IC50 = 5e-06 nM 454.62 O=C(CCCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4443426 IC50 = 5e-06 nM 440.59 O=C(CCCCNc1c2c(nc3ccccc13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4468781 IC50 = 5e-06 nM 553.53 COc1ccc2[nH]cc(CCNC(=O)CCCCCNc3c4c(nc5cc(Cl)cc(Cl)c35)CCCC4)c2c1 Homo sapiens CHEMBL4342697 single protein format
CHEMBL4451843 IC50 = 0.0076 nM 488.64 O=C(NCCCCCNc1c2c(nc3ccccc13)CCCC2)c1c2ccccc2nc2ccccc12 Homo sapiens CHEMBL4326148 single protein format
CHEMBL4589980 IC50 = 0.008 nM 503.09 O=C(CCCCCCNc1c2c(nc3cccc(Cl)c13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL4391927 single protein format
CHEMBL199585 IC50 = 0.008 nM 537.54 O=C(CCCCCCNc1c2c(nc3cc(Cl)cc(Cl)c13)CCCC2)NCCc1c[nH]c2ccccc12 Homo sapiens CHEMBL864026 single protein format