null

SMILES: [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1

InChI Key: InChIKey=SFNHWRUBLKGHQX-NMBNTWCXSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50253138   

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)	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.301	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair
Mu-type opioid receptor (MOUSE)	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	0.383	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	31	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig cerebellum membrane				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.90	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Agonist activity at human mu opioid receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins by Eu...				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	50	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins by...				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50253138 (CHEMBL4076303) Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4| Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	0.430	n/a	n/a	n/a	n/a
Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 30 mins by...				Bioorg Med Chem Lett 27: 2742-2745 (2017) Article DOI: 10.1016/j.bmcl.2017.04.059 BindingDB Entry DOI: 10.7270/Q2H134GP
					More data for this Ligand-Target Pair