null

SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

InChI Key: InChIKey=WAYPCKDSUVRAAV-ZZPXSOBZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50252411   

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))	BDBM50252411 ((1S,2S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C35H40N6O5/c36-27(17-22-13-15-24(42)16-14-22)34(45)39-29-12-6-10-26(29)33(44)41-31(19-23-20-38-28-11-5-4-9-25(23)28)35(46)40-30(32(37)43)18-21-7-2-1-3-8-21/h1-5,7-9,11,13-16,20,26-27,29-31,38,42H,6,10,12,17-19,36H2,(H2,37,43)(H,39,45)(H,40,46)(H,41,44)/t26-,27-,29-,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19.9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]endomorphin-2 from mu opioid receptor in Wistar rat brain				J Med Chem 51: 4270-9 (2008) Article DOI: 10.1021/jm800223t BindingDB Entry DOI: 10.7270/Q2QC038R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50252411 ((1S,2S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C35H40N6O5/c36-27(17-22-13-15-24(42)16-14-22)34(45)39-29-12-6-10-26(29)33(44)41-31(19-23-20-38-28-11-5-4-9-25(23)28)35(46)40-30(32(37)43)18-21-7-2-1-3-8-21/h1-5,7-9,11,13-16,20,26-27,29-31,38,42H,6,10,12,17-19,36H2,(H2,37,43)(H,39,45)(H,40,46)(H,41,44)/t26-,27-,29-,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	86	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in Wistar rat brain				J Med Chem 51: 4270-9 (2008) Article DOI: 10.1021/jm800223t BindingDB Entry DOI: 10.7270/Q2QC038R
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50252411 ((1S,2S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C35H40N6O5/c36-27(17-22-13-15-24(42)16-14-22)34(45)39-29-12-6-10-26(29)33(44)41-31(19-23-20-38-28-11-5-4-9-25(23)28)35(46)40-30(32(37)43)18-21-7-2-1-3-8-21/h1-5,7-9,11,13-16,20,26-27,29-31,38,42H,6,10,12,17-19,36H2,(H2,37,43)(H,39,45)(H,40,46)(H,41,44)/t26-,27-,29-,30-,31-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.08E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Displacement of [3H]Ile5,6deltorphin-2 from delta opioid receptor in Wistar rat brain				J Med Chem 51: 4270-9 (2008) Article DOI: 10.1021/jm800223t BindingDB Entry DOI: 10.7270/Q2QC038R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50252411 ((1S,2S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C35H40N6O5/c36-27(17-22-13-15-24(42)16-14-22)34(45)39-29-12-6-10-26(29)33(44)41-31(19-23-20-38-28-11-5-4-9-25(23)28)35(46)40-30(32(37)43)18-21-7-2-1-3-8-21/h1-5,7-9,11,13-16,20,26-27,29-31,38,42H,6,10,12,17-19,36H2,(H2,37,43)(H,39,45)(H,40,46)(H,41,44)/t26-,27-,29-,30-,31-/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	n/a	n/a	4.15E+3	n/a	n/a	n/a	n/a
Hungarian Academy of Sciences Curated by ChEMBL					Assay Description Activity at mu opioid receptor in Wistar rat brain assessed as stimulation of [35S]GTPgammaS binding				J Med Chem 51: 4270-9 (2008) Article DOI: 10.1021/jm800223t BindingDB Entry DOI: 10.7270/Q2QC038R
					More data for this Ligand-Target Pair