BDBM50209304 (S)-N-((S)-1-((S)-1-amino-1-oxohexan-2-ylamino)-1-oxo-3-phenylpropan-2-yl)-1-((S)-2-amino-3-(4-hydroxyphenyl)propanoyl)pyrrolidine-2-carboxamide::CHEMBL243200

SMILES: CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O

InChI Key: InChIKey=SPUAJJZGAKWXAZ-QORCZRPOSA-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 = 50209304   

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))	BDBM50209304 ((S)-N-((S)-1-((S)-1-amino-1-oxohexan-2-ylamino)-1-...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C29H39N5O5/c1-2-3-10-23(26(31)36)32-27(37)24(18-19-8-5-4-6-9-19)33-28(38)25-11-7-16-34(25)29(39)22(30)17-20-12-14-21(35)15-13-20/h4-6,8-9,12-15,22-25,35H,2-3,7,10-11,16-18,30H2,1H3,(H2,31,36)(H,32,37)(H,33,38)/t22-,23-,24-,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33.9	n/a	n/a	n/a	n/a	n/a	n/a
Kyushu University Curated by ChEMBL					Assay Description Displacement of [3H]DAGO from mu opioid receptor in rat brain membrane				Bioorg Med Chem 15: 3883-8 (2007) Article DOI: 10.1016/j.bmc.2007.03.009 BindingDB Entry DOI: 10.7270/Q2QZ2BS0
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50209304 ((S)-N-((S)-1-((S)-1-amino-1-oxohexan-2-ylamino)-1-...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C29H39N5O5/c1-2-3-10-23(26(31)36)32-27(37)24(18-19-8-5-4-6-9-19)33-28(38)25-11-7-16-34(25)29(39)22(30)17-20-12-14-21(35)15-13-20/h4-6,8-9,12-15,22-25,35H,2-3,7,10-11,16-18,30H2,1H3,(H2,31,36)(H,32,37)(H,33,38)/t22-,23-,24-,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Kyushu University Curated by ChEMBL					Assay Description Displacement of [3H]deltorphin2 from delta opioid receptor in rat brain membrane				Bioorg Med Chem 15: 3883-8 (2007) Article DOI: 10.1016/j.bmc.2007.03.009 BindingDB Entry DOI: 10.7270/Q2QZ2BS0
					More data for this Ligand-Target Pair