BDBM50058658 18-cyclopropylmethyl-5-phenyl-10-oxa-7,18-diazahexacyclo[9.9.1.01,9.02,17.04,8.015,21]henicosa-4(8),5,11,13,15(21)-pentaene-2,12-diol::CHEMBL305146

SMILES: Oc1ccc2CC3N(CC4CC4)CCC45[C@@H](Oc1c24)c1[nH]cc(c1C[C@@]35O)-c1ccccc1

InChI Key: InChIKey=HELJBCMRZADMRA-AMLGIXIYSA-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 = 50058658   

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)	BDBM50058658 (18-cyclopropylmethyl-5-phenyl-10-oxa-7,18-diazahex...) Show SMILES Oc1ccc2CC3N(CC4CC4)CCC45[C@@H](Oc1c24)c1[nH]cc(c1C[C@@]35O)-c1ccccc1 |TLB:26:25:18.4.5:7.13.12,THB:8:7:25:18.4.5,17:18:25:7.13.12| Show InChI InChI=1S/C28H28N2O3/c31-21-9-8-18-12-22-28(32)13-19-20(17-4-2-1-3-5-17)14-29-24(19)26-27(28,23(18)25(21)33-26)10-11-30(22)15-16-6-7-16/h1-5,8-9,14,16,22,26,29,31-32H,6-7,10-13,15H2/t22?,26-,27?,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 receptor binding in ICR mouse brain membranes using the radioligand [3H]naltrindole				J Med Chem 40: 1977-81 (1997) Article DOI: 10.1021/jm970189y BindingDB Entry DOI: 10.7270/Q2J38T7Q
					More data for this Ligand-Target Pair
Mu-type opioid receptor (MOUSE)	BDBM50058658 (18-cyclopropylmethyl-5-phenyl-10-oxa-7,18-diazahex...) Show SMILES Oc1ccc2CC3N(CC4CC4)CCC45[C@@H](Oc1c24)c1[nH]cc(c1C[C@@]35O)-c1ccccc1 |TLB:26:25:18.4.5:7.13.12,THB:8:7:25:18.4.5,17:18:25:7.13.12| Show InChI InChI=1S/C28H28N2O3/c31-21-9-8-18-12-22-28(32)13-19-20(17-4-2-1-3-5-17)14-29-24(19)26-27(28,23(18)25(21)33-26)10-11-30(22)15-16-6-7-16/h1-5,8-9,14,16,22,26,29,31-32H,6-7,10-13,15H2/t22?,26-,27?,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 binding in ICR mouse brain membranes using the radioligand [3H][Ala2,Glyol5]enkephalin				J Med Chem 40: 1977-81 (1997) Article DOI: 10.1021/jm970189y BindingDB Entry DOI: 10.7270/Q2J38T7Q
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Mus musculus (Mouse))	BDBM50058658 (18-cyclopropylmethyl-5-phenyl-10-oxa-7,18-diazahex...) Show SMILES Oc1ccc2CC3N(CC4CC4)CCC45[C@@H](Oc1c24)c1[nH]cc(c1C[C@@]35O)-c1ccccc1 |TLB:26:25:18.4.5:7.13.12,THB:8:7:25:18.4.5,17:18:25:7.13.12| Show InChI InChI=1S/C28H28N2O3/c31-21-9-8-18-12-22-28(32)13-19-20(17-4-2-1-3-5-17)14-29-24(19)26-27(28,23(18)25(21)33-26)10-11-30(22)15-16-6-7-16/h1-5,8-9,14,16,22,26,29,31-32H,6-7,10-13,15H2/t22?,26-,27?,28+/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor kappa 1 binding in ICR mouse brain membranes using the radioligand [3H]U-69593				J Med Chem 40: 1977-81 (1997) Article DOI: 10.1021/jm970189y BindingDB Entry DOI: 10.7270/Q2J38T7Q
					More data for this Ligand-Target Pair