null

SMILES: COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N

InChI Key: InChIKey=ZVRXOXFSMYJETP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 50342038   

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
Translocator protein (Rattus norvegicus (rat))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Displacement of [3H]PK11195 from TSPO receptor in rat kidney membranes				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62.2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	798	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Binding affinity to kappa opioid receptor by radioligand binding assay				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.89E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB2 receptor				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Binding affinity to 5HT2A receptor by radioligand binding assay				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Binding affinity to 5HT1D receptor by radioligand binding assay				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair
D(1B) dopamine receptor (Homo sapiens (Human))	BDBM50342038 (1-(2-Bromophenyl)-N-(4-cyanotetrahydro-2H-pyran-4-...) Show SMILES COc1ccc(cc1)-c1c(C)c(nn1-c1ccccc1Br)C(=O)NC1(CCOCC1)C#N Show InChI InChI=1S/C24H23BrN4O3/c1-16-21(23(30)27-24(15-26)11-13-32-14-12-24)28-29(20-6-4-3-5-19(20)25)22(16)17-7-9-18(31-2)10-8-17/h3-10H,11-14H2,1-2H3,(H,27,30)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Mental Health Curated by ChEMBL					Assay Description Binding affinity to opamine D5 receptor by radioligand binding assay				J Med Chem 54: 2961-70 (2011) Article DOI: 10.1021/jm2000536 BindingDB Entry DOI: 10.7270/Q2KS6SJS
					More data for this Ligand-Target Pair