BDBM50041148 (S)-2-Amino-3-(4-hydroxy-phenyl)-N-((5S,8S,13aR)-5-naphthalen-2-ylmethyl-4,7,13-trioxo-tetradecahydro-3a,6,12-triaza-cyclopentacyclododecen-8-yl)-propionamide::CHEMBL280264

SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCNC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O

InChI Key: InChIKey=LABQDBMZPVLBTI-LAJGZZDBSA-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 = 50041148   

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 (Rattus norvegicus (rat))	BDBM50041148 ((S)-2-Amino-3-(4-hydroxy-phenyl)-N-((5S,8S,13aR)-5...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCNC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O Show InChI InChI=1S/C32H37N5O5/c33-25(18-20-10-13-24(38)14-11-20)29(39)35-26-7-3-15-34-31(41)28-8-4-16-37(28)32(42)27(36-30(26)40)19-21-9-12-22-5-1-2-6-23(22)17-21/h1-2,5-6,9-14,17,25-28,38H,3-4,7-8,15-16,18-19,33H2,(H,34,41)(H,35,39)(H,36,40)/t25-,26-,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity for mu opioid receptors by displacement of [3H]-DAMGO from rat brain membrane binding site				J Med Chem 37: 1136-44 (1994) BindingDB Entry DOI: 10.7270/Q22Z1650
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50041148 ((S)-2-Amino-3-(4-hydroxy-phenyl)-N-((5S,8S,13aR)-5...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCCNC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O Show InChI InChI=1S/C32H37N5O5/c33-25(18-20-10-13-24(38)14-11-20)29(39)35-26-7-3-15-34-31(41)28-8-4-16-37(28)32(42)27(36-30(26)40)19-21-9-12-22-5-1-2-6-23(22)17-21/h1-2,5-6,9-14,17,25-28,38H,3-4,7-8,15-16,18-19,33H2,(H,34,41)(H,35,39)(H,36,40)/t25-,26-,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity for delta opioid receptors was determined by displacement of [3H]DSLET from rat brain membrane binding site				J Med Chem 37: 1136-44 (1994) BindingDB Entry DOI: 10.7270/Q22Z1650
					More data for this Ligand-Target Pair