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BDBM50173688 3-[6-(3,4-Difluoro-phenyl)-pyridazin-4-yl]-benzonitrile::CHEMBL381670

SMILES: Fc1ccc(cc1F)-c1cc(cnn1)-c1cccc(c1)C#N

InChI Key: InChIKey=BKJDICAMUYQJHV-UHFFFAOYSA-N

Data: 2 KI

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 = 50173688   
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
GABA receptor alpha-5/beta-3/gamma-2 subunit


(Homo sapiens (Human))
BDBM50173688
PNG
(3-[6-(3,4-Difluoro-phenyl)-pyridazin-4-yl]-benzoni...)
Show SMILES Fc1ccc(cc1F)-c1cc(cnn1)-c1cccc(c1)C#N
Show InChI InChI=1S/C17H9F2N3/c18-15-5-4-13(7-16(15)19)17-8-14(10-21-22-17)12-3-1-2-11(6-12)9-20/h1-8,10H
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
13n/an/an/an/an/an/a7.4n/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 15-1788 binding from human recombinant Gamma-aminobutyric-acid A receptor alpha5-beta3-gamma2 expressed in mouse fibroblast ...


J Med Chem 48: 6004-11 (2005)


Article DOI: 10.1021/jm050249x
BindingDB Entry DOI: 10.7270/Q26H4GZH
More data for this
Ligand-Target Pair
GABA receptor alpha-3/beta-3/gamma-2 subunit


(Homo sapiens (Human))
BDBM50173688
PNG
(3-[6-(3,4-Difluoro-phenyl)-pyridazin-4-yl]-benzoni...)
Show SMILES Fc1ccc(cc1F)-c1cc(cnn1)-c1cccc(c1)C#N
Show InChI InChI=1S/C17H9F2N3/c18-15-5-4-13(7-16(15)19)17-8-14(10-21-22-17)12-3-1-2-11(6-12)9-20/h1-8,10H
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
41n/an/an/an/an/an/a7.4n/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-Ro- 15-1788 binding from human recombinant Gamma-aminobutyric-acid A receptor alpha3-beta3-gamma2 expressed in mouse fibroblast ...


J Med Chem 48: 6004-11 (2005)


Article DOI: 10.1021/jm050249x
BindingDB Entry DOI: 10.7270/Q26H4GZH
More data for this
Ligand-Target Pair