BDBM50140908 13-methoxy-19-methyl-6-phenyl-(2S,10R)-11-oxa-8,19-diazahexacyclo[10.9.1.01,10.02,18.04,9.016,22]docosa-4(9),5,7,12,14,16(22)-hexaen-2-ol

SMILES: COc1ccc2CC3N(C)CC[C@@]45[C@@H](Oc1c24)c1ncc(cc1C[C@@]35O)-c1ccccc1

InChI Key: InChIKey=SEZIWIPCUUCNMT-SSNGLDLMSA-N

Data: 3 KI

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 3 hits for monomerid = 50140908   

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
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50140908 (13-methoxy-19-methyl-6-phenyl-(2S,10R)-11-oxa-8,19...) Show SMILES COc1ccc2CC3N(C)CC[C@@]45[C@@H](Oc1c24)c1ncc(cc1C[C@@]35O)-c1ccccc1 |TLB:4:5:24:8.11.10| Show InChI InChI=1S/C27H26N2O3/c1-29-11-10-26-22-17-8-9-20(31-2)24(22)32-25(26)23-18(14-27(26,30)21(29)13-17)12-19(15-28-23)16-6-4-3-5-7-16/h3-9,12,15,21,25,30H,10-11,13-14H2,1-2H3/t21?,25-,26-,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Southern Research Institute Curated by ChEMBL					Assay Description Binding affinity at opioid receptor delta 1 by displacement of [3H]DADLE in rat brain membrane				J Med Chem 47: 1400-12 (2004) Article DOI: 10.1021/jm030311v BindingDB Entry DOI: 10.7270/Q2639QGW
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50140908 (13-methoxy-19-methyl-6-phenyl-(2S,10R)-11-oxa-8,19...) Show SMILES COc1ccc2CC3N(C)CC[C@@]45[C@@H](Oc1c24)c1ncc(cc1C[C@@]35O)-c1ccccc1 |TLB:4:5:24:8.11.10| Show InChI InChI=1S/C27H26N2O3/c1-29-11-10-26-22-17-8-9-20(31-2)24(22)32-25(26)23-18(14-27(26,30)21(29)13-17)12-19(15-28-23)16-6-4-3-5-7-16/h3-9,12,15,21,25,30H,10-11,13-14H2,1-2H3/t21?,25-,26-,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	894	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Southern Research Institute Curated by ChEMBL					Assay Description Binding affinity at Opioid receptor mu 1 by displacement of [3H]DAMGO at 1.4 to 3.0 nM in rat brain membrane				J Med Chem 47: 1400-12 (2004) Article DOI: 10.1021/jm030311v BindingDB Entry DOI: 10.7270/Q2639QGW
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50140908 (13-methoxy-19-methyl-6-phenyl-(2S,10R)-11-oxa-8,19...) Show SMILES COc1ccc2CC3N(C)CC[C@@]45[C@@H](Oc1c24)c1ncc(cc1C[C@@]35O)-c1ccccc1 |TLB:4:5:24:8.11.10| Show InChI InChI=1S/C27H26N2O3/c1-29-11-10-26-22-17-8-9-20(31-2)24(22)32-25(26)23-18(14-27(26,30)21(29)13-17)12-19(15-28-23)16-6-4-3-5-7-16/h3-9,12,15,21,25,30H,10-11,13-14H2,1-2H3/t21?,25-,26-,27+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Southern Research Institute Curated by ChEMBL					Assay Description Binding affinity at Opioid receptor kappa 1 by displacement of [3H]U-69593 in guinea pig brain membranes				J Med Chem 47: 1400-12 (2004) Article DOI: 10.1021/jm030311v BindingDB Entry DOI: 10.7270/Q2639QGW
					More data for this Ligand-Target Pair