null

SMILES: COCCOCCO[C@H]1C=CC2[C@@H](Cc3ccc(OC)c4O[C@@H]1[C@]2(C)c34)N(C)C

InChI Key: InChIKey=QWZBRCDEZVLUAO-MLFORTSJSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 425914   

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 (Homo sapiens (Human))	BDBM425914 (US10512644, Compound alpha-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2[C@@H](Cc3ccc(OC)c4O[C@@H]1[C@]2(C)c34)N(C)C |r,c:9| Show InChI InChI=1S/C23H33NO5/c1-23-16-7-9-19(28-13-12-27-11-10-25-4)22(23)29-21-18(26-5)8-6-15(20(21)23)14-17(16)24(2)3/h6-9,16-17,19,22H,10-14H2,1-5H3/t16?,17-,19+,22+,23+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.38E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Inheris Pharmaceuticals, Inc. US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US10512644 (2019) BindingDB Entry DOI: 10.7270/Q2RN3B8V
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM425914 (US10512644, Compound alpha-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2[C@@H](Cc3ccc(OC)c4O[C@@H]1[C@]2(C)c34)N(C)C |r,c:9| Show InChI InChI=1S/C23H33NO5/c1-23-16-7-9-19(28-13-12-27-11-10-25-4)22(23)29-21-18(26-5)8-6-15(20(21)23)14-17(16)24(2)3/h6-9,16-17,19,22H,10-14H2,1-5H3/t16?,17-,19+,22+,23+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.26E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Inheris Pharmaceuticals, Inc. US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US10512644 (2019) BindingDB Entry DOI: 10.7270/Q2RN3B8V
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM425914 (US10512644, Compound alpha-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2[C@@H](Cc3ccc(OC)c4O[C@@H]1[C@]2(C)c34)N(C)C |r,c:9| Show InChI InChI=1S/C23H33NO5/c1-23-16-7-9-19(28-13-12-27-11-10-25-4)22(23)29-21-18(26-5)8-6-15(20(21)23)14-17(16)24(2)3/h6-9,16-17,19,22H,10-14H2,1-5H3/t16?,17-,19+,22+,23+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	5.15E+3	n/a	n/a	n/a	n/a
Inheris Pharmaceuticals, Inc. US Patent					Assay Description Briefly, suspensions of cells expressing either the mu, kappa or delta opioid receptors were prepared in buffer containing 0.5 mM isobutyl-methyl xan...				US Patent US10512644 (2019) BindingDB Entry DOI: 10.7270/Q2RN3B8V
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM425914 (US10512644, Compound alpha-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2[C@@H](Cc3ccc(OC)c4O[C@@H]1[C@]2(C)c34)N(C)C |r,c:9| Show InChI InChI=1S/C23H33NO5/c1-23-16-7-9-19(28-13-12-27-11-10-25-4)22(23)29-21-18(26-5)8-6-15(20(21)23)14-17(16)24(2)3/h6-9,16-17,19,22H,10-14H2,1-5H3/t16?,17-,19+,22+,23+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	4.01E+4	n/a	n/a	n/a	n/a
Inheris Pharmaceuticals, Inc. US Patent					Assay Description Briefly, suspensions of cells expressing either the mu, kappa or delta opioid receptors were prepared in buffer containing 0.5 mM isobutyl-methyl xan...				US Patent US10512644 (2019) BindingDB Entry DOI: 10.7270/Q2RN3B8V
					More data for this Ligand-Target Pair