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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Peripheral-Type Benzodiazepine Receptor' and Ligand = 'BDBM50159081'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50159081
PNG
(CHEMBL362632 | N-Cyclohexyl-2-[6,8-dichloro-2-(4-c...)
Show SMILES Clc1ccc(cc1)-c1nc2c(Cl)cc(Cl)cn2c1CC(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl3N3O/c22-14-8-6-13(7-9-14)20-18(11-19(28)25-16-4-2-1-3-5-16)27-12-15(23)10-17(24)21(27)26-20/h6-10,12,16H,1-5,11H2,(H,25,28)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
140n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK11195 from peripheral benzodiazepine receptor of rat cerebral cortex


J Med Chem 48: 292-305 (2005)


Article DOI: 10.1021/jm049610q
BindingDB Entry DOI: 10.7270/Q2RR1XQ0
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50159081
PNG
(CHEMBL362632 | N-Cyclohexyl-2-[6,8-dichloro-2-(4-c...)
Show SMILES Clc1ccc(cc1)-c1nc2c(Cl)cc(Cl)cn2c1CC(=O)NC1CCCCC1
Show InChI InChI=1S/C21H20Cl3N3O/c22-14-8-6-13(7-9-14)20-18(11-19(28)25-16-4-2-1-3-5-16)27-12-15(23)10-17(24)21(27)26-20/h6-10,12,16H,1-5,11H2,(H,25,28)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
749n/an/an/an/an/an/an/an/a



Università degli Studi di Bari

Curated by ChEMBL


Assay Description
Displacement of [3H]-PK11195 from peripheral benzodiazepine receptor of rat ovary


J Med Chem 48: 292-305 (2005)


Article DOI: 10.1021/jm049610q
BindingDB Entry DOI: 10.7270/Q2RR1XQ0
More data for this
Ligand-Target Pair