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Target
Steroid 21-hydroxylase
Ligand
BDBM50206959
Substrate
n/a
Meas. Tech.
ChEMBL_1629495 (CHEMBL3872121)
IC50
>10000±n/a nM
Citation
 Whitehead, BR; Lo, MM; Ali, A; Park, MK; Hoyt, SB; Xiong, Y; Cai, J; Carswell, E; Cooke, A; MacLean, J; Ratcliffe, P; Robinson, J; Bennett, DJ; Clemas, JA; Wisniewski, T; Struthers, M; Cully, D; MacNeil, DJ Imidazopyridyl compounds as aldosterone synthase inhibitors. Bioorg Med Chem Lett 27:143-146 (2017) [PubMed]  Article 
Target
Name:
Steroid 21-hydroxylase
Synonyms:
CP21A_HUMAN | CYP21 | CYP21A2 | CYP21B | Cytochrome P450 21 | Cytochrome P450 21A2
Type:
PROTEIN
Mol. Mass.:
55896.25
Organism:
Homo sapiens (Human)
Description:
ChEMBL_1498865
Residue:
494
Sequence:
MLLLGLLLLPLLAGARLLWNWWKLRSLHLPPLAPGFLHLLQPDLPIYLLGLTQKFGPIYRLHLGLQDVVVLNSKRTIEEAMVKKWADFAGRPEPLTYKLVSKNYPDLSLGDYSLLWKAHKKLTRSALLLGIRDSMEPVVEQLTQEFCERMRAQPGTPVAIEEEFSLLTCSIICYLTFGDKIKDDNLMPAYYKCIQEVLKTWSHWSIQIVDVIPFLRFFPNPGLRRLKQAIEKRDHIVEMQLRQHKESLVAGQWRDMMDYMLQGVAQPSMEEGSGQLLEGHVHMAAVDLLIGGTETTANTLSWAVVFLLHHPEIQQRLQEELDHELGPGASSSRVPYKDRARLPLLNATIAEVLRLRPVVPLALPHRTTRPSSISGYDIPEGTVIIPNLQGAHLDETVWERPHEFWPDRFLEPGKNSRALAFGCGARVCLGEPLARLELFVVLTRLLQAFTLLPSGDALPSLQPLPHCSVILKMQPFQVRLQPRGMGAHSPGQNQ
  
Inhibitor
Name:
BDBM50206959
Synonyms:
CHEMBL3924257
Type:
Small organic molecule
Emp. Form.:
C16H13F2N3
Mol. Mass.:
285.2913
SMILES:
Cc1c(F)cncc1-c1nc2ccc(F)cn2c1C1CC1
Structure:
Search PDB for entries with ligand similarity: