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BDBM50421100 CHEMBL2088358

SMILES: CN(C(=O)Cn1c2cccc(-c3ccccc3)c2oc1=O)c1ccccc1

InChI Key: InChIKey=CKEASTBJJGXWIN-UHFFFAOYSA-N

Data: 2 KI

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 = 50421100   
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
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50421100
PNG
(CHEMBL2088358)
Show SMILES CN(C(=O)Cn1c2cccc(-c3ccccc3)c2oc1=O)c1ccccc1
Show InChI InChI=1S/C22H18N2O3/c1-23(17-11-6-3-7-12-17)20(25)15-24-19-14-8-13-18(21(19)27-22(24)26)16-9-4-2-5-10-16/h2-14H,15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Dainippon Sumitomo Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO receptor in rat Sprague-Dawley kidney membranes after 1 hr by liquid scintillation counting


Bioorg Med Chem 20: 5568-82 (2012)


Article DOI: 10.1016/j.bmc.2012.07.023
BindingDB Entry DOI: 10.7270/Q2DF6SGW
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50421100
PNG
(CHEMBL2088358)
Show SMILES CN(C(=O)Cn1c2cccc(-c3ccccc3)c2oc1=O)c1ccccc1
Show InChI InChI=1S/C22H18N2O3/c1-23(17-11-6-3-7-12-17)20(25)15-24-19-14-8-13-18(21(19)27-22(24)26)16-9-4-2-5-10-16/h2-14H,15H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9n/an/an/an/an/an/an/an/a



Dainippon Sumitomo Pharma Co. Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]PK11195 from TSPO in Sprague-Dawley rat kidney mitochondria after 1 hr by liquid scintillation counting analysis


Bioorg Med Chem 21: 1257-67 (2013)


Article DOI: 10.1016/j.bmc.2012.12.024
BindingDB Entry DOI: 10.7270/Q28053ZS
More data for this
Ligand-Target Pair