BindingDB logo
myBDB logout

null

SMILES: NC(=O)C(C#N)C1=Nc2ccccc2CC1

InChI Key: InChIKey=CSLYYANFKQQLRM-UHFFFAOYSA-N

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 = 41014   
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
Protein-tyrosine kinase 2-beta


(Homo sapiens (Human))
BDBM41014
PNG
((2E)-2-cyano-2-(3,4-dihydro-1H-quinolin-2-ylidene)...)
Show SMILES NC(=O)C(C#N)C1=Nc2ccccc2CC1 |t:6|
Show InChI InChI=1S/C12H11N3O/c13-7-9(12(14)16)11-6-5-8-3-1-2-4-10(8)15-11/h1-4,9H,5-6H2,(H2,14,16)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.37E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2H993M3
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM41014
PNG
((2E)-2-cyano-2-(3,4-dihydro-1H-quinolin-2-ylidene)...)
Show SMILES NC(=O)C(C#N)C1=Nc2ccccc2CC1 |t:6|
Show InChI InChI=1S/C12H11N3O/c13-7-9(12(14)16)11-6-5-8-3-1-2-4-10(8)15-11/h1-4,9H,5-6H2,(H2,14,16)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.85E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2GX48ZN
More data for this
Ligand-Target Pair