Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetSteroid 5-alpha-reductase
LigandBDBM50213061
Substrate/Competitorn/a
Meas. Tech.ChEMBL_204732
Ki 5±n/a nM
Citation Rasmusson, GHReynolds, GFSteinberg, NGWalton, EPatel, GFLiang, TCascieri, MACheung, AHBrooks, JRBerman, C Azasteroids: structure-activity relationships for inhibition of 5 alpha-reductase and of androgen receptor binding. J Med Chem29:2298-315 (1986) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Steroid 5-alpha-reductase
Name:Steroid 5-alpha-reductase
Synonyms:n/a
Type:n/a
Mol. Mass.:n/a
Description:ASSAY_ID of ChEMBL is 204723
Components:This complex has 2 components.
Component 1
Name:Steroid 5-alpha-reductase
Synonyms:Steroid 5-alpha-reductase 1
Type:PROTEIN
Mol. Mass.:29788.29
Organism:Rattus norvegicus
Description:ChEMBL_1441437
Residue:259
Sequence:
MVPLMELDELCLLDMLVYLEGFMAFVSIVGLRSVGSPYGRYSPQWPGIRVPARPAWFIQE
LPSMAWPLYEYIRPAAARLGNLPNRVLLAMFLIHYVQRTLVFPVLIRGGKPTLLVTFVLA
FLFCTFNGYVQSRYLSQFAVYAEDWVTHPCFLTGFALWLVGMVINIHSDHILRNLRKPGE
TGYKIPRGGLFEYVSAANYFGELVEWCGFALASWSLQGVVFALFTLSTLLTRAKQHHQWY
HEKFEDYPKSRKILIPFVL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
Component 2
Name:Steroid 5-alpha-reductase
Synonyms:Steroid 5-alpha-reductase 2
Type:PROTEIN
Mol. Mass.:28784.15
Organism:Rattus norvegicus
Description:ChEMBL_205054
Residue:254
Sequence:
MQIVCHQVPVLAGSATLATMGTLILCLGKPASYGKHTESVSSGVPFLPARIAWFLQELPS
FVVSVGMLAWQPRSLFGPPGNVLLALFSAHYFHRTFIYSLLTRGRPFPAVLFLRATAFCI
GNGLLQAYYLVYCAEYPEEWYTDVRFSFGVFLFILGMGINIHSDYTLRQLRKPGEVIYRI
PRGGLFTYVSGANFLGEIIEWIGYALATWSVPAFAFAFFTLCFLGMQAFYHHRFYLKMFK
DYPKSRKALIPFIF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50213061
NameBDBM50213061
Synonyms:CHEMBL2298601
TypeSmall organic molecule
Emp. Form.C24H40N2O2
Mol. Mass.388.5866
SMILESCCN(CC)C(=O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4N(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least:
n/a