null

SMILES: NC[C@@H]1OC(Cc2ccccc2)Cc2c(O)c(O)ccc12

InChI Key: InChIKey=XVBBSQGJSIEXFQ-INSVYWFGSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50007150   

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 (RAT)	BDBM50007150 (1-Aminomethyl-3-benzyl-isochroman-5,6-diol | CHEMB...) Show SMILES NC[C@@H]1OC(Cc2ccccc2)Cc2c(O)c(O)ccc12 Show InChI InChI=1S/C17H19NO3/c18-10-16-13-6-7-15(19)17(20)14(13)9-12(21-16)8-11-4-2-1-3-5-11/h1-7,12,16,19-20H,8-10,18H2/t12?,16-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	443	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity using [125 I] SCH 23982 radioligand competitive binding assay on dopamine receptor D1				J Med Chem 34: 2561-9 (1991) BindingDB Entry DOI: 10.7270/Q2HM57DN
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50007150 (1-Aminomethyl-3-benzyl-isochroman-5,6-diol | CHEMB...) Show SMILES NC[C@@H]1OC(Cc2ccccc2)Cc2c(O)c(O)ccc12 Show InChI InChI=1S/C17H19NO3/c18-10-16-13-6-7-15(19)17(20)14(13)9-12(21-16)8-11-4-2-1-3-5-11/h1-7,12,16,19-20H,8-10,18H2/t12?,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.47E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity using [3H]-spiperone radioligand competitive binding assay against dopamine receptor D2				J Med Chem 34: 2561-9 (1991) BindingDB Entry DOI: 10.7270/Q2HM57DN
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50007150 (1-Aminomethyl-3-benzyl-isochroman-5,6-diol | CHEMB...) Show SMILES NC[C@@H]1OC(Cc2ccccc2)Cc2c(O)c(O)ccc12 Show InChI InChI=1S/C17H19NO3/c18-10-16-13-6-7-15(19)17(20)14(13)9-12(21-16)8-11-4-2-1-3-5-11/h1-7,12,16,19-20H,8-10,18H2/t12?,16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of Dopamine receptor D1 activity by functional cyclase assay using cell free homogenate of rat striatum				J Med Chem 34: 2561-9 (1991) BindingDB Entry DOI: 10.7270/Q2HM57DN
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (Homo sapiens (Human))	BDBM50007150 (1-Aminomethyl-3-benzyl-isochroman-5,6-diol | CHEMB...) Show SMILES NC[C@@H]1OC(Cc2ccccc2)Cc2c(O)c(O)ccc12 Show InChI InChI=1S/C17H19NO3/c18-10-16-13-6-7-15(19)17(20)14(13)9-12(21-16)8-11-4-2-1-3-5-11/h1-7,12,16,19-20H,8-10,18H2/t12?,16-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	34	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Concentration required to inhibit 50% dopamine receptor D1 activity using cell free homogenate of carp retina				J Med Chem 34: 2561-9 (1991) BindingDB Entry DOI: 10.7270/Q2HM57DN
					More data for this Ligand-Target Pair