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BDBM50192697 CHEMBL3969020

SMILES: Fc1ccc(cc1)C1CC(=NN1C(=O)Nc1ccccn1)c1ccc(Br)cc1

InChI Key: InChIKey=HBXXOZGTEHENQK-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50192697   
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
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM50192697
PNG
(CHEMBL3969020)
Show SMILES Fc1ccc(cc1)C1CC(=NN1C(=O)Nc1ccccn1)c1ccc(Br)cc1 |c:10|
Show InChI InChI=1S/C21H16BrFN4O/c22-16-8-4-14(5-9-16)18-13-19(15-6-10-17(23)11-7-15)27(26-18)21(28)25-20-3-1-2-12-24-20/h1-12,19H,13H2,(H,24,25,28)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 393n/an/an/an/an/an/a



Actelion Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of recombinant T-type calcium channel Cav3.2 (unknown origin) expressed in HEK293 cells assessed as inhibition of CaCl2-induced calcium in...


J Med Chem 59: 8398-411 (2016)


BindingDB Entry DOI: 10.7270/Q2J67JWK
More data for this
Ligand-Target Pair
Voltage-gated calcium channel


(Homo sapiens (Human))
BDBM50192697
PNG
(CHEMBL3969020)
Show SMILES Fc1ccc(cc1)C1CC(=NN1C(=O)Nc1ccccn1)c1ccc(Br)cc1 |c:10|
Show InChI InChI=1S/C21H16BrFN4O/c22-16-8-4-14(5-9-16)18-13-19(15-6-10-17(23)11-7-15)27(26-18)21(28)25-20-3-1-2-12-24-20/h1-12,19H,13H2,(H,24,25,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.18E+3n/an/an/an/an/an/a



Actelion Pharmaceuticals Ltd.

Curated by ChEMBL


Assay Description
Inhibition of recombinant T-type calcium channel Cav1.2 (unknown origin) expressed in HEK293 cells assessed as inhibition of Kcl-induced calcium infl...


J Med Chem 59: 8398-411 (2016)


BindingDB Entry DOI: 10.7270/Q2J67JWK
More data for this
Ligand-Target Pair