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BDBM50052758 1-(5-Phenyl-6-oxa-10b-aza-benzo[e]azulen-4-yl)-ethanone::CHEMBL323793

SMILES: CC(=O)C1=C(Oc2ccccc2-n2cccc12)c1ccccc1

InChI Key: InChIKey=SPAPKFUJIGQDCD-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50052758   
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))
BDBM50052758
PNG
(1-(5-Phenyl-6-oxa-10b-aza-benzo[e]azulen-4-yl)-eth...)
Show SMILES CC(=O)C1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:3|
Show InChI InChI=1S/C20H15NO2/c1-14(22)19-17-11-7-13-21(17)16-10-5-6-12-18(16)23-20(19)15-8-3-2-4-9-15/h2-13H,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
25n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity against peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate using [3H]-PK 11195 as radioligand


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor


(Rattus norvegicus (rat))
BDBM50052758
PNG
(1-(5-Phenyl-6-oxa-10b-aza-benzo[e]azulen-4-yl)-eth...)
Show SMILES CC(=O)C1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:3|
Show InChI InChI=1S/C20H15NO2/c1-14(22)19-17-11-7-13-21(17)16-10-5-6-12-18(16)23-20(19)15-8-3-2-4-9-15/h2-13H,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 65n/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]-PK 11195 to peripheral-type benzodiazepine receptor (PBR) from rat cortex homogenate


J Med Chem 39: 3435-50 (1996)


Article DOI: 10.1021/jm960251b
BindingDB Entry DOI: 10.7270/Q23B60SK
More data for this
Ligand-Target Pair