BDBM50118536 4-Methyl-piperazine-1-carboxylic acid 5-phenyl-6-oxa-10b-aza-benzo[e]azulen-4-yl ester::CHEMBL135807

SMILES: CN1CCN(CC1)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1

InChI Key: InChIKey=VHPGHALYSSHBTF-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 = 50118536   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50118536 (4-Methyl-piperazine-1-carboxylic acid 5-phenyl-6-o...) Show SMILES CN1CCN(CC1)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:11| Show InChI InChI=1S/C24H23N3O3/c1-25-14-16-26(17-15-25)24(28)30-23-20-11-7-13-27(20)19-10-5-6-12-21(19)29-22(23)18-8-3-2-4-9-18/h2-13H,14-17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	7.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of [3H]-PK11195 binding to Peripheral type benzodiazepine receptor (PBR) in rat cortex homogenate by 50%				J Med Chem 45: 4276-81 (2002) BindingDB Entry DOI: 10.7270/Q20Z72MT
					More data for this Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50118536 (4-Methyl-piperazine-1-carboxylic acid 5-phenyl-6-o...) Show SMILES CN1CCN(CC1)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:11| Show InChI InChI=1S/C24H23N3O3/c1-25-14-16-26(17-15-25)24(28)30-23-20-11-7-13-27(20)19-10-5-6-12-21(19)29-22(23)18-8-3-2-4-9-18/h2-13H,14-17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-5-4864 binding to mitochondrial rat testis Peripheral type benzodiazepine receptor (PBR)				J Med Chem 45: 4276-81 (2002) BindingDB Entry DOI: 10.7270/Q20Z72MT
					More data for this Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50118536 (4-Methyl-piperazine-1-carboxylic acid 5-phenyl-6-o...) Show SMILES CN1CCN(CC1)C(=O)OC1=C(Oc2ccccc2-n2cccc12)c1ccccc1 |t:11| Show InChI InChI=1S/C24H23N3O3/c1-25-14-16-26(17-15-25)24(28)30-23-20-11-7-13-27(20)19-10-5-6-12-21(19)29-22(23)18-8-3-2-4-9-18/h2-13H,14-17H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita' degli Studi di Siena Curated by ChEMBL					Assay Description Inhibition of [3H]-PK11195 binding to mitochondrial rat testis Peripheral type benzodiazepine receptor (PBR)				J Med Chem 45: 4276-81 (2002) BindingDB Entry DOI: 10.7270/Q20Z72MT
					More data for this Ligand-Target Pair