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BDBM5177 3-amino-5-[(1Z)-1-cyano-2-(1H-indol-3-yl)eth-1-en-1-yl]-1H-pyrazole-4-carbonitrile::Indole-Containing Inhibitor 11

SMILES: Nc1[nH]nc(C(=Cc2c[nH]c3ccccc23)C#N)c1C#N

InChI Key: InChIKey=OJMXHLJIMZMFGX-UHFFFAOYSA-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 = 5177   
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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM5177
PNG
(3-amino-5-[(1Z)-1-cyano-2-(1H-indol-3-yl)eth-1-en-...)
Show SMILES Nc1[nH]nc(C(=Cc2c[nH]c3ccccc23)C#N)c1C#N |w:6.6|
Show InChI InChI=1S/C15H10N6/c16-6-9(14-12(7-17)15(18)21-20-14)5-10-8-19-13-4-2-1-3-11(10)13/h1-5,8,19H,(H3,18,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



Hebrew University of Jerusalem



Assay Description
The assay was using Swiss 3T3 cell membranes harboring EGF-R or PDGFR-beta. Receptor autophosphorylation was initiated by addition of [gamma-32P]ATP ...


J Med Chem 39: 2170-7 (1996)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2QF8R2N
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM5177
PNG
(3-amino-5-[(1Z)-1-cyano-2-(1H-indol-3-yl)eth-1-en-...)
Show SMILES Nc1[nH]nc(C(=Cc2c[nH]c3ccccc23)C#N)c1C#N |w:6.6|
Show InChI InChI=1S/C15H10N6/c16-6-9(14-12(7-17)15(18)21-20-14)5-10-8-19-13-4-2-1-3-11(10)13/h1-5,8,19H,(H3,18,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+5n/an/an/an/a7.54



Hebrew University of Jerusalem



Assay Description
The assay was using Swiss 3T3 cell membranes harboring EGF-R or PDGFR-beta. Receptor autophosphorylation was initiated by addition of [gamma-32P]ATP ...


J Med Chem 39: 2170-7 (1996)


Article DOI: 10.1021/jm950727b
BindingDB Entry DOI: 10.7270/Q2QF8R2N
More data for this
Ligand-Target Pair