BDBM50010295 8-Bromo-3-methyl-5-[4-(7-nitro-benzo[1,2,5]oxadiazol-4-ylamino)-phenyl]-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ol::CHEMBL322760

SMILES: CN1CCc2cc(Br)c(O)cc2C(C1)c1ccc(Nc2ccc([N+]([O-])=O)c3n[o+][n-]c23)cc1

InChI Key: InChIKey=PAOQGQGDDFSBTF-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50010295   

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
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50010295 (8-Bromo-3-methyl-5-[4-(7-nitro-benzo[1,2,5]oxadiaz...) Show SMILES CN1CCc2cc(Br)c(O)cc2C(C1)c1ccc(Nc2ccc([N+]([O-])=O)c3n[o+][n-]c23)cc1 Show InChI InChI=1S/C23H20BrN5O4/c1-28-9-8-14-10-18(24)21(30)11-16(14)17(12-28)13-2-4-15(5-3-13)25-19-6-7-20(29(31)32)23-22(19)26-33-27-23/h2-7,10-11,17,25,30H,8-9,12H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Biochemicals Inc. Curated by ChEMBL					Assay Description Binding affinity against dopamine receptor D1 by using [3H]-SCH- 23390 as radioligand in caudate-putamen of monkey				J Med Chem 34: 3235-41 (1991) BindingDB Entry DOI: 10.7270/Q2KS6S5V
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Homo sapiens (Human))	BDBM50010295 (8-Bromo-3-methyl-5-[4-(7-nitro-benzo[1,2,5]oxadiaz...) Show SMILES CN1CCc2cc(Br)c(O)cc2C(C1)c1ccc(Nc2ccc([N+]([O-])=O)c3n[o+][n-]c23)cc1 Show InChI InChI=1S/C23H20BrN5O4/c1-28-9-8-14-10-18(24)21(30)11-16(14)17(12-28)13-2-4-15(5-3-13)25-19-6-7-20(29(31)32)23-22(19)26-33-27-23/h2-7,10-11,17,25,30H,8-9,12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	710	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Biochemicals Inc. Curated by ChEMBL					Assay Description Binding affinity against dopamine receptor D2 by using [3H]spiperone as radioligand in caudate-putamen of monkey				J Med Chem 34: 3235-41 (1991) BindingDB Entry DOI: 10.7270/Q2KS6S5V
					More data for this Ligand-Target Pair