BDBM50222199 CHEMBL157948

SMILES: Oc1cc(Br)c(CC2NCCc3cc(O)c(O)cc23)cc1O

InChI Key: InChIKey=HOSYDJXLEUQGSX-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 = 50222199   

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
Adrenergic receptor alpha (Rattus norvegicus (rat)-Rattus norvegicus (Rat)-RA...)	BDBM50222199 (CHEMBL157948) Show SMILES Oc1cc(Br)c(CC2NCCc3cc(O)c(O)cc23)cc1O Show InChI InChI=1S/C16H16BrNO4/c17-11-7-16(22)14(20)5-9(11)3-12-10-6-15(21)13(19)4-8(10)1-2-18-12/h4-7,12,18-22H,1-3H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]WB-4101 binding to alpha adrenergic receptor from rat cerebral cortical membranes				J Med Chem 23: 648-52 (1980) BindingDB Entry DOI: 10.7270/Q2P2719M
					More data for this Ligand-Target Pair
Dopamine receptor (Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)	BDBM50222199 (CHEMBL157948) Show SMILES Oc1cc(Br)c(CC2NCCc3cc(O)c(O)cc23)cc1O Show InChI InChI=1S/C16H16BrNO4/c17-11-7-16(22)14(20)5-9(11)3-12-10-6-15(21)13(19)4-8(10)1-2-18-12/h4-7,12,18-22H,1-3H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]spiroperidol binding to dopamine receptor from rat striatum membranes				J Med Chem 23: 648-52 (1980) BindingDB Entry DOI: 10.7270/Q2P2719M
					More data for this Ligand-Target Pair
Adrenergic receptor beta (Rattus norvegicus (Rat))	BDBM50222199 (CHEMBL157948) Show SMILES Oc1cc(Br)c(CC2NCCc3cc(O)c(O)cc23)cc1O Show InChI InChI=1S/C16H16BrNO4/c17-11-7-16(22)14(20)5-9(11)3-12-10-6-15(21)13(19)4-8(10)1-2-18-12/h4-7,12,18-22H,1-3H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [3H]dihydroalprenolol binding to Beta adrenergic receptor from rat cerebral cortical membranes				J Med Chem 23: 648-52 (1980) BindingDB Entry DOI: 10.7270/Q2P2719M
					More data for this Ligand-Target Pair