BDBM50422801 CHEMBL382761

SMILES: C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1

InChI Key: InChIKey=FZFSEHRCJNQRIE-ISVMRZDUSA-N

Data: 3 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 3 hits for monomerid = 50422801   

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
Mu-type opioid receptor (GUINEA PIG)	BDBM50422801 (CHEMBL382761) Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1 Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Agonist activity at mu opioid receptor in myentric plexus muscle from guinea pig				Bioorg Med Chem Lett 16: 905-10 (2006) Article DOI: 10.1016/j.bmcl.2005.10.102 BindingDB Entry DOI: 10.7270/Q2930VG2
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50422801 (CHEMBL382761) Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1 Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Agonist activity at delta opioid receptor in mouse vas deferens				Bioorg Med Chem Lett 16: 905-10 (2006) Article DOI: 10.1016/j.bmcl.2005.10.102 BindingDB Entry DOI: 10.7270/Q2930VG2
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50422801 (CHEMBL382761) Show SMILES C[C@@H]1CN([C@H](c2ccc3CN(Cc3c2)C(=O)c2cccc(c2)C(O)=O)c2cccc(O)c2)[C@@H](C)CN1Cc1ccccc1 Show InChI InChI=1S/C36H37N3O4/c1-24-20-39(25(2)19-37(24)21-26-8-4-3-5-9-26)34(27-10-7-13-33(40)18-27)28-14-15-31-22-38(23-32(31)16-28)35(41)29-11-6-12-30(17-29)36(42)43/h3-18,24-25,34,40H,19-23H2,1-2H3,(H,42,43)/t24-,25+,34+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Agonist activity at kappa opioid receptor in myentric plexus muscle from guinea pig				Bioorg Med Chem Lett 16: 905-10 (2006) Article DOI: 10.1016/j.bmcl.2005.10.102 BindingDB Entry DOI: 10.7270/Q2930VG2
					More data for this Ligand-Target Pair