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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Steroid 17-alpha-hydroxylase/17,20 lyase' and Ligand = 'BDBM208944'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Steroid 17-alpha-hydroxylase/17,20 lyase


(Homo sapiens (Human))
BDBM208944
PNG
(US9266880, 2)
Show SMILES Fc1ccc(cc1)-n1ncc2c(ccnc12)-n1ccnc1
Show InChI InChI=1S/C15H10FN5/c16-11-1-3-12(4-2-11)21-15-13(9-19-21)14(5-6-18-15)20-8-7-17-10-20/h1-10H
PDB

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KEGG

UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
UniChem
US Patent
n/an/a 640n/an/an/an/a7.24



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...


US Patent US9266880 (2016)


BindingDB Entry DOI: 10.7270/Q24T6H69
More data for this
Ligand-Target Pair