BDBM50081526 (S)-2-Amino-N-{(R)-1-[({(S)-2-[N'-((R)-2-amino-3-phenyl-propionyl)-hydrazino]-1-benzyl-2-oxo-ethylcarbamoyl}-methyl)-carbamoyl]-ethyl}-3-(4-hydroxy-phenyl)-propionamide::CHEMBL328902

SMILES: C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](N)Cc1ccccc1

InChI Key: InChIKey=NIQHZEXPDYAPRQ-YJECHUCRSA-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 = 50081526   

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 (Homo sapiens (Human))	BDBM50081526 ((S)-2-Amino-N-{(R)-1-[({(S)-2-[N'-((R)-2-amino-3-p...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C32H39N7O6/c1-20(36-30(43)25(33)17-23-12-14-24(40)15-13-23)29(42)35-19-28(41)37-27(18-22-10-6-3-7-11-22)32(45)39-38-31(44)26(34)16-21-8-4-2-5-9-21/h2-15,20,25-27,40H,16-19,33-34H2,1H3,(H,35,42)(H,36,43)(H,37,41)(H,38,44)(H,39,45)/t20-,25+,26-,27+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.740	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description In vitro binding affinity towards mu opioid receptors was determined using [3H]-[p-Cl-Phe]- 4] DPDPE or [3H]-Deltorphin II				Bioorg Med Chem Lett 9: 2763-6 (1999) BindingDB Entry DOI: 10.7270/Q2RF5T7W
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50081526 ((S)-2-Amino-N-{(R)-1-[({(S)-2-[N'-((R)-2-amino-3-p...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)NNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C32H39N7O6/c1-20(36-30(43)25(33)17-23-12-14-24(40)15-13-23)29(42)35-19-28(41)37-27(18-22-10-6-3-7-11-22)32(45)39-38-31(44)26(34)16-21-8-4-2-5-9-21/h2-15,20,25-27,40H,16-19,33-34H2,1H3,(H,35,42)(H,36,43)(H,37,41)(H,38,44)(H,39,45)/t20-,25+,26-,27+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description In vitro binding affinity towards Opioid receptor delta 1 was determined using [3H]-DAMGO or [3H]-CTOP				Bioorg Med Chem Lett 9: 2763-6 (1999) BindingDB Entry DOI: 10.7270/Q2RF5T7W
					More data for this Ligand-Target Pair