BDBM50314881 CHEMBL1089543::CHEMBL1089873::cis-N-(3-(Guanidinomethyl)benzyl)-N-(4-phenylethylcyclohexyl)-propionamide

SMILES: [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1

InChI Key: InChIKey=LXDISLJEMANODO-UHFFFAOYSA-N

Data: 6 KI  4 IC50

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 10 hits for monomerid = 50314881   

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
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	162	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	224	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	238	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.11E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.82E+3	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	590	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	521	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50314881 (CHEMBL1089543 | CHEMBL1089873 | cis-N-(3-(Guanidin...) Show SMILES [#6]-[#6]-[#6](=O)-[#6](=[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1)-[#6]-1-[#6]-[#6]-[#7](-[#6]-[#6]-c2ccccc2)-[#6]-[#6]-1 |w:5.5| Show InChI InChI=1S/C26H34N4O/c1-2-25(31)24(18-21-9-6-10-22(17-21)19-29-26(27)28)23-12-15-30(16-13-23)14-11-20-7-4-3-5-8-20/h3-10,17-18,23H,2,11-16,19H2,1H3,(H4,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction				J Med Chem 53: 2875-81 (2010) Article DOI: 10.1021/jm9019068 BindingDB Entry DOI: 10.7270/Q21G0N7R
					More data for this Ligand-Target Pair