BDBM50234128 CHEMBL4083911

SMILES: [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)C\C(=C/c1ccccc1)C2=O)ccc3O

InChI Key: InChIKey=BAYMCCNRWJPNES-QHQLREDOSA-N

Data: 3 KI  1 EC50

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 4 hits for monomerid = 50234128   

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 (Homo sapiens (Human))	BDBM50234128 (CHEMBL4083911) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)C\C(=C/c1ccccc1)C2=O)ccc3O |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C24H23NO4/c1-25-10-9-23-19-15-7-8-17(26)21(19)29-22(23)20(27)16(11-14-5-3-2-4-6-14)13-24(23,28)18(25)12-15/h2-8,11,18,22,26,28H,9-10,12-13H2,1H3/b16-11+/t18-,22+,23+,24-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
West Virginia University School of Pharmacy Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from human DOR expressed in CHO cells				Bioorg Med Chem Lett 27: 666-669 (2017) BindingDB Entry DOI: 10.7270/Q22V2JBQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50234128 (CHEMBL4083911) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)C\C(=C/c1ccccc1)C2=O)ccc3O |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C24H23NO4/c1-25-10-9-23-19-15-7-8-17(26)21(19)29-22(23)20(27)16(11-14-5-3-2-4-6-14)13-24(23,28)18(25)12-15/h2-8,11,18,22,26,28H,9-10,12-13H2,1H3/b16-11+/t18-,22+,23+,24-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
West Virginia University School of Pharmacy Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human MOR expressed in CHO cells				Bioorg Med Chem Lett 27: 666-669 (2017) BindingDB Entry DOI: 10.7270/Q22V2JBQ
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50234128 (CHEMBL4083911) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)C\C(=C/c1ccccc1)C2=O)ccc3O |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C24H23NO4/c1-25-10-9-23-19-15-7-8-17(26)21(19)29-22(23)20(27)16(11-14-5-3-2-4-6-14)13-24(23,28)18(25)12-15/h2-8,11,18,22,26,28H,9-10,12-13H2,1H3/b16-11+/t18-,22+,23+,24-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
West Virginia University School of Pharmacy Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from human KOR expressed in CHO cells				Bioorg Med Chem Lett 27: 666-669 (2017) BindingDB Entry DOI: 10.7270/Q22V2JBQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50234128 (CHEMBL4083911) Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(C)CC[C@@]14[C@@]5(O)C\C(=C/c1ccccc1)C2=O)ccc3O |r,THB:10:9:14:4.5.6| Show InChI InChI=1S/C24H23NO4/c1-25-10-9-23-19-15-7-8-17(26)21(19)29-22(23)20(27)16(11-14-5-3-2-4-6-14)13-24(23,28)18(25)12-15/h2-8,11,18,22,26,28H,9-10,12-13H2,1H3/b16-11+/t18-,22+,23+,24-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	72	n/a	n/a	n/a	n/a
West Virginia University School of Pharmacy Curated by ChEMBL					Assay Description Agonist activity at MOR (unknown origin) by [35S]GTPgamma binding assay				Bioorg Med Chem Lett 27: 666-669 (2017) BindingDB Entry DOI: 10.7270/Q22V2JBQ
					More data for this Ligand-Target Pair