BDBM50224277 CHEMBL280309

SMILES: [H][C@@]12Oc3c4c(CC5N(CC=C)CC[C@@]14[C@]5(CCC2=O)OCC)ccc3O

InChI Key: InChIKey=GFVVFDWQEIJFDF-GSPFLADASA-N

Data: 2 IC50

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 = 50224277   

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
Opioid receptor (Rattus norvegicus (rat)-RAT)	BDBM50224277 (CHEMBL280309) Show SMILES [H][C@@]12Oc3c4c(CC5N(CC=C)CC[C@@]14[C@]5(CCC2=O)OCC)ccc3O |THB:9:8:15:4.5.6| Show InChI InChI=1S/C21H25NO4/c1-3-10-22-11-9-20-17-13-5-6-14(23)18(17)26-19(20)15(24)7-8-21(20,25-4-2)16(22)12-13/h3,5-6,16,19,23H,1,4,7-12H2,2H3/t16?,19-,20-,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of stereospecific [3H]diprenorphine binding to opioid receptors of rat brain homogenates by 50% in the presence of Na				J Med Chem 25: 116-20 (1982) BindingDB Entry DOI: 10.7270/Q2NZ89V4
					More data for this Ligand-Target Pair
Opioid receptor (Rattus norvegicus (rat)-RAT)	BDBM50224277 (CHEMBL280309) Show SMILES [H][C@@]12Oc3c4c(CC5N(CC=C)CC[C@@]14[C@]5(CCC2=O)OCC)ccc3O |THB:9:8:15:4.5.6| Show InChI InChI=1S/C21H25NO4/c1-3-10-22-11-9-20-17-13-5-6-14(23)18(17)26-19(20)15(24)7-8-21(20,25-4-2)16(22)12-13/h3,5-6,16,19,23H,1,4,7-12H2,2H3/t16?,19-,20-,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of stereospecific [3H]diprenorphine binding to opioid receptors of rat brain homogenates by 50% in the absence of Na				J Med Chem 25: 116-20 (1982) BindingDB Entry DOI: 10.7270/Q2NZ89V4
					More data for this Ligand-Target Pair