null

SMILES: CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O

InChI Key: InChIKey=JQANFDBJZOIYMB-QJCLFNHPSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50009181   

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 (Rattus norvegicus (rat))	BDBM50009181 (2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-33(41(60)50-32(15-17-66-4)40(59)54-36(44(63)64)22-37(46)56)51-43(62)35(21-28-23-47-24-48-28)53-42(61)34(20-26-8-6-5-7-9-26)52-39(58)31(14-16-65-3)49-38(57)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,56)(H,47,48)(H,49,57)(H,50,60)(H,51,62)(H,52,58)(H,53,61)(H,54,59)(H,63,64)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Displacement of [3H]- DPDPE from delta opioid receptor in rat brain membrane				J Med Chem 34: 1656-61 (1991) BindingDB Entry DOI: 10.7270/Q2XW4KCF
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50009181 (2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-33(41(60)50-32(15-17-66-4)40(59)54-36(44(63)64)22-37(46)56)51-43(62)35(21-28-23-47-24-48-28)53-42(61)34(20-26-8-6-5-7-9-26)52-39(58)31(14-16-65-3)49-38(57)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,56)(H,47,48)(H,49,57)(H,50,60)(H,51,62)(H,52,58)(H,53,61)(H,54,59)(H,63,64)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Inhibition of opioid receptor mu in guinea pig ileum (GPI)				J Med Chem 34: 1656-61 (1991) BindingDB Entry DOI: 10.7270/Q2XW4KCF
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50009181 (2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-33(41(60)50-32(15-17-66-4)40(59)54-36(44(63)64)22-37(46)56)51-43(62)35(21-28-23-47-24-48-28)53-42(61)34(20-26-8-6-5-7-9-26)52-39(58)31(14-16-65-3)49-38(57)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,56)(H,47,48)(H,49,57)(H,50,60)(H,51,62)(H,52,58)(H,53,61)(H,54,59)(H,63,64)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane				J Med Chem 34: 1656-61 (1991) BindingDB Entry DOI: 10.7270/Q2XW4KCF
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50009181 (2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-33(41(60)50-32(15-17-66-4)40(59)54-36(44(63)64)22-37(46)56)51-43(62)35(21-28-23-47-24-48-28)53-42(61)34(20-26-8-6-5-7-9-26)52-39(58)31(14-16-65-3)49-38(57)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,56)(H,47,48)(H,49,57)(H,50,60)(H,51,62)(H,52,58)(H,53,61)(H,54,59)(H,63,64)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description Displacement of [3H]- DAGO from opioid receptor mu in rat brain membrane				J Med Chem 34: 1656-61 (1991) BindingDB Entry DOI: 10.7270/Q2XW4KCF
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50009181 (2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(N)=O)C(O)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-33(41(60)50-32(15-17-66-4)40(59)54-36(44(63)64)22-37(46)56)51-43(62)35(21-28-23-47-24-48-28)53-42(61)34(20-26-8-6-5-7-9-26)52-39(58)31(14-16-65-3)49-38(57)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,56)(H,47,48)(H,49,57)(H,50,60)(H,51,62)(H,52,58)(H,53,61)(H,54,59)(H,63,64)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
University of Ferrara Curated by ChEMBL					Assay Description In vitro opioid receptor delta mediated mouse vas deferens (MVD) assay				J Med Chem 34: 1656-61 (1991) BindingDB Entry DOI: 10.7270/Q2XW4KCF
					More data for this Ligand-Target Pair