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BDBM50173690 CHEMBL371717::[5-(3-Bromo-phenyl)-pyridazin-3-yl]-dimethyl-amine

SMILES: CN(C)c1cc(cnn1)-c1cccc(Br)c1

InChI Key: InChIKey=JMXJXXYVELWEHX-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50173690   
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))
BDBM50173690
PNG
(CHEMBL371717 | [5-(3-Bromo-phenyl)-pyridazin-3-yl]...)
Show SMILES CN(C)c1cc(cnn1)-c1cccc(Br)c1
Show InChI InChI=1S/C12H12BrN3/c1-16(2)12-7-10(8-14-15-12)9-4-3-5-11(13)6-9/h3-8H,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
51n/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-1/beta-3/gamma-2 subunit


(Homo sapiens (Human))
BDBM50173690
PNG
(CHEMBL371717 | [5-(3-Bromo-phenyl)-pyridazin-3-yl]...)
Show SMILES CN(C)c1cc(cnn1)-c1cccc(Br)c1
Show InChI InChI=1S/C12H12BrN3/c1-16(2)12-7-10(8-14-15-12)9-4-3-5-11(13)6-9/h3-8H,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
55n/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 alpha1-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))
BDBM50173690
PNG
(CHEMBL371717 | [5-(3-Bromo-phenyl)-pyridazin-3-yl]...)
Show SMILES CN(C)c1cc(cnn1)-c1cccc(Br)c1
Show InChI InChI=1S/C12H12BrN3/c1-16(2)12-7-10(8-14-15-12)9-4-3-5-11(13)6-9/h3-8H,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
120n/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