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SMILES: Fc1ccc(cc1)-c1cnc2c(ccnn12)-c1cccnc1

InChI Key: InChIKey=IIXVLRGPFRCYFK-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 183400   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM183400
PNG
(US9145419, 26)
Show SMILES Fc1ccc(cc1)-c1cnc2c(ccnn12)-c1cccnc1
Show InChI InChI=1S/C17H11FN4/c18-14-5-3-12(4-6-14)16-11-20-17-15(7-9-21-22(16)17)13-2-1-8-19-10-13/h1-11H
PDB

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Similars

US Patent
n/an/a 524n/an/an/an/a7.225



Bristol-Myers Squibb Company

US Patent


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


US Patent US9145419 (2015)


BindingDB Entry DOI: 10.7270/Q208643N
More data for this
Ligand-Target Pair