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Target
Sex hormone-binding globulin
Ligand
BDBM50200090
Substrate
n/a
Meas. Tech.
ChEMBL_422532 (CHEMBL911029)
IC50
48230±n/a nM
Citation
 Cherkasov, A; Ban, F; Li, Y; Fallahi, M; Hammond, GL Progressive docking: a hybrid QSAR/docking approach for accelerating in silico high throughput screening. J Med Chem 49:7466-78 (2006) [PubMed]  Article 
Target
Name:
Sex hormone-binding globulin
Synonyms:
SHBG | SHBG_HUMAN | Testis-specific androgen-binding protein
Type:
PROTEIN
Mol. Mass.:
43780.19
Organism:
Homo sapiens (Human)
Description:
ChEMBL_466706
Residue:
402
Sequence:
MESRGPLATSRLLLLLLLLLLRHTRQGWALRPVLPTQSAHDPPAVHLSNGPGQEPIAVMTFDLTKITKTSSSFEVRTWDPEGVIFYGDTNPKDDWFMLGLRDGRPEIQLHNHWAQLTVGAGPRLDDGRWHQVEVKMEGDSVLLEVDGEEVLRLRQVSGPLTSKRHPIMRIALGGLLFPASNLRLPLVPALDGCLRRDSWLDKQAEISASAPTSLRSCDVESNPGIFLPPGTQAEFNLRDIPQPHAEPWAFSLDLGLKQAAGSGHLLALGTPENPSWLSLHLQDQKVVLSSGSGPGLDLPLVLGLPLQLKLSMSRVVLSQGSKMKALALPPLGLAPLLNLWAKPQGRLFLGALPGEDSSTSFCLNGLWAQGQRLDVDQALNRSHEIWTHSCPQSPGNGTDASH
  
Inhibitor
Name:
BDBM50200090
Synonyms:
4-(4-hydroxy-3-(hydroxymethyl)-5-methylbenzyl)-2-(hydroxymethyl)-6-methylphenol | CHEMBL218958 | NSC-48435
Type:
Small organic molecule
Emp. Form.:
C17H20O4
Mol. Mass.:
288.3383
SMILES:
Cc1cc(Cc2cc(C)c(O)c(CO)c2)cc(CO)c1O
Structure:
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