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BDBM97207 (Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(2-pyridinyl)-2-propenenitrile::(Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(2-pyridyl)acrylonitrile::(Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-pyridin-2-yl-prop-2-enenitrile::(Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-pyridin-2-ylprop-2-enenitrile::MLS000392107::SMR000261058::cid_6153030

SMILES: CN(CCC#N)c1ccc(\C=C(/C#N)c2ccccn2)cc1

InChI Key: InChIKey=KKOLAURUHPEUNE-DTQAZKPQSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 97207   
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
Steroidogenic factor 1


(Homo sapiens (Human))
BDBM97207
PNG
((Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(2-p...)
Show SMILES CN(CCC#N)c1ccc(\C=C(/C#N)c2ccccn2)cc1
Show InChI InChI=1S/C18H16N4/c1-22(12-4-10-19)17-8-6-15(7-9-17)13-16(14-20)18-5-2-3-11-21-18/h2-3,5-9,11,13H,4,12H2,1H3/b16-13+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>6.75E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2ZG6QV9
More data for this
Ligand-Target Pair
Nuclear receptor subfamily 0 group B member 1


(Homo sapiens (Human))
BDBM97207
PNG
((Z)-3-[4-[2-cyanoethyl(methyl)amino]phenyl]-2-(2-p...)
Show SMILES CN(CCC#N)c1ccc(\C=C(/C#N)c2ccccn2)cc1
Show InChI InChI=1S/C18H16N4/c1-22(12-4-10-19)17-8-6-15(7-9-17)13-16(14-20)18-5-2-3-11-21-18/h2-3,5-9,11,13H,4,12H2,1H3/b16-13+
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>834n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q23777B0
More data for this
Ligand-Target Pair