BDBM50363527 CHEMBL1945412::US9481685, [18F]FE-PBR

SMILES: CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF

InChI Key: InChIKey=NVQSVEQNCOWDBV-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50363527   

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
Benzodiazepine receptors; peripheral & central (Rattus norvegicus (rat))	BDBM50363527 (CHEMBL1945412 | US9481685, [18F]FE-PBR) Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar	CHEMBL PC cid PC sid UniChem Patents	PubMed	0.220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GE Healthcare Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates				Bioorg Med Chem Lett 23: 2368-72 (2013) BindingDB Entry DOI: 10.7270/Q2PR7ZW9
					More data for this Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50363527 (CHEMBL1945412 | US9481685, [18F]FE-PBR) Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	0.670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GE Healthcare Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO receptor in Wistar rat heart homogenate after 15 mins				Bioorg Med Chem Lett 22: 1308-13 (2012) Article DOI: 10.1016/j.bmcl.2011.12.084 BindingDB Entry DOI: 10.7270/Q2RR1ZPZ
					More data for this Ligand-Target Pair
Benzodiazepine receptors; peripheral & central (Rattus norvegicus (rat))	BDBM50363527 (CHEMBL1945412 | US9481685, [18F]FE-PBR) Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar	CHEMBL PC cid PC sid UniChem Patents	PubMed	0.680	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GE Healthcare Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates				Bioorg Med Chem Lett 23: 2368-72 (2013) BindingDB Entry DOI: 10.7270/Q2PR7ZW9
					More data for this Ligand-Target Pair
Peripheral-Type Benzodiazepine Receptor (Rattus norvegicus (rat))	BDBM50363527 (CHEMBL1945412 | US9481685, [18F]FE-PBR) Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar	CHEMBL PC cid PC sid UniChem Patents	US Patent	0.680	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
GE Healthcare Limited US Patent					Assay Description The compounds were screened for their affinity for PBR using a method adapted from Le Fur et al (Life Sci. 1983; USA 33: 449-57).The compounds to be ...				US Patent US9481685 (2016) BindingDB Entry DOI: 10.7270/Q25M64NT
					More data for this Ligand-Target Pair
Benzodiazepine receptors; peripheral & central (Rattus norvegicus (rat))	BDBM50363527 (CHEMBL1945412 | US9481685, [18F]FE-PBR) Show SMILES CCN(CC)C(=O)C1Sc2ccccc2-c2c1c1ccccc1n2CCF Show InChI InChI=1S/C22H23FN2OS/c1-3-24(4-2)22(26)21-19-15-9-5-7-11-17(15)25(14-13-23)20(19)16-10-6-8-12-18(16)27-21/h5-12,21H,3-4,13-14H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar	CHEMBL PC cid PC sid UniChem Patents	PubMed	5.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GE Healthcare Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates				Bioorg Med Chem Lett 23: 2368-72 (2013) BindingDB Entry DOI: 10.7270/Q2PR7ZW9
					More data for this Ligand-Target Pair