Reaction Details Report a problem with these data
Target
Alpha-ketoglutarate-dependent dioxygenase FTO
Ligand
BDBM50193145
Substrate
n/a
Meas. Tech.
ChEMBL_947323 (CHEMBL2344107)
IC50
2800±n/a nM
Citation
Aik, W; Demetriades, M; Hamdan, MK; Bagg, EA; Yeoh, KK; Lejeune, C; Zhang, Z; McDonough, MA; Schofield, CJ Structural basis for inhibition of the fat mass and obesity associated protein (FTO). J Med Chem 56:3680-8 (2013) [PubMed] Article
More Info.:
Target
Name:
Alpha-ketoglutarate-dependent dioxygenase FTO
Synonyms:
FTO | FTO_HUMAN | Fat mass and obesity-associated protein | KIAA1752
Type:
PROTEIN
Mol. Mass.:
58263.75
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1515854
Residue:
505
Sequence:
MKRTPTAEEREREAKKLRLLEELEDTWLPYLTPKDDEFYQQWQLKYPKLILREASSVSEELHKEVQEAFLTLHKHGCLFRDLVRIQGKDLLTPVSRILIGNPGCTYKYLNTRLFTVPWPVKGSNIKHTEAEIAAACETFLKLNDYLQIETIQALEELAAKEKANEDAVPLCMSADFPRVGMGSSYNGQDEVDIKSRAAYNVTLLNFMDPQKMPYLKEEPYFGMGKMAVSWHHDENLVDRSAVAVYSYSCEGPEEESEDDSHLEGRDPDIWHVGFKISWDIETPGLAIPLHQGDCYFMLDDLNATHQHCVLAGSQPRFSSTHRVAECSTGTLDYILQRCQLALQNVCDDVDNDDVSLKSFEPAVLKQGEEIHNEVEFEWLRQFWFQGNRYRKCTDWWCQPMAQLEALWKKMEGVTNAVLHEVKREGLPVEQRNEILTAILASLTARQNLRREWHARCQSRIARTLPADQKPECRPYWEKDDASMPLPFDLTDIVSELRGQLLEAKP
Inhibitor
Name:
BDBM50193145
Synonyms:
2-(1-chloro-4-hydroxyisoquinoline-3-carboxamido)acetic acid | CHEMBL426560 | Isoquinoline 3 | N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-3-YL)CARBONYL]GLYCINE
Type:
Small organic molecule
Emp. Form.:
C12H9ClN2O4
Mol. Mass.:
280.664
SMILES:
OC(=O)CNC(=O)c1nc(Cl)c2ccccc2c1O