null

SMILES: CC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)O

InChI Key: InChIKey=IEVGUHJUACDFNA-AMGAHSPLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50453339   

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
Delta-type opioid receptor (MOUSE)	BDBM50453339 (CHEMBL2372412) Show SMILES CC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)O Show InChI InChI=1S/C32H45N5O7S2/c1-6-22-27(40)35-23(17-18-10-8-7-9-11-18)28(41)37-25(30(43)44)32(4,5)46-45-31(2,3)24(29(42)34-22)36-26(39)21(33)16-19-12-14-20(38)15-13-19/h7-15,21-25,30,38,43-44H,6,16-17,33H2,1-5H3,(H,34,42)(H,35,40)(H,36,39)(H,37,41)/t21-,22-,23-,24+,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	85	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibitory activity of the electrically induced smooth muscle contraction of mouse vas deferens				J Med Chem 37: 1572-7 (1994) BindingDB Entry DOI: 10.7270/Q2DR2W47
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50453339 (CHEMBL2372412) Show SMILES CC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)O Show InChI InChI=1S/C32H45N5O7S2/c1-6-22-27(40)35-23(17-18-10-8-7-9-11-18)28(41)37-25(30(43)44)32(4,5)46-45-31(2,3)24(29(42)34-22)36-26(39)21(33)16-19-12-14-20(38)15-13-19/h7-15,21-25,30,38,43-44H,6,16-17,33H2,1-5H3,(H,34,42)(H,35,40)(H,36,39)(H,37,41)/t21-,22-,23-,24+,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Evaluation for the binding affinity by competitive inhibition of [3H]- CTOP binding				J Med Chem 37: 1572-7 (1994) BindingDB Entry DOI: 10.7270/Q2DR2W47
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50453339 (CHEMBL2372412) Show SMILES CC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)O Show InChI InChI=1S/C32H45N5O7S2/c1-6-22-27(40)35-23(17-18-10-8-7-9-11-18)28(41)37-25(30(43)44)32(4,5)46-45-31(2,3)24(29(42)34-22)36-26(39)21(33)16-19-12-14-20(38)15-13-19/h7-15,21-25,30,38,43-44H,6,16-17,33H2,1-5H3,(H,34,42)(H,35,40)(H,36,39)(H,37,41)/t21-,22-,23-,24+,25+/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibitory activity of the electrically induced guinea pig ileum longitudal muscle-myenteric plexus				J Med Chem 37: 1572-7 (1994) BindingDB Entry DOI: 10.7270/Q2DR2W47
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50453339 (CHEMBL2372412) Show SMILES CC[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(C)(C)SSC(C)(C)[C@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(O)O Show InChI InChI=1S/C32H45N5O7S2/c1-6-22-27(40)35-23(17-18-10-8-7-9-11-18)28(41)37-25(30(43)44)32(4,5)46-45-31(2,3)24(29(42)34-22)36-26(39)21(33)16-19-12-14-20(38)15-13-19/h7-15,21-25,30,38,43-44H,6,16-17,33H2,1-5H3,(H,34,42)(H,35,40)(H,36,39)(H,37,41)/t21-,22-,23-,24+,25+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Evaluation for the binding affinity by competitive inhibition of [3H]- p-chloro DPDPE binding				J Med Chem 37: 1572-7 (1994) BindingDB Entry DOI: 10.7270/Q2DR2W47
					More data for this Ligand-Target Pair