BDBM50045792 3-[3,4-Dimethyl-1-(4-methyl-pent-4-enyl)-piperidin-4-yl]-phenol::CHEMBL96022

SMILES: C[C@H]1CN(CCCC(C)=C)CC[C@@]1(C)c1cccc(O)c1

InChI Key: InChIKey=ZUDHJLYIFCXWCE-QFBILLFUSA-N

Data: 2 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 2 hits for monomerid = 50045792   

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 (Rattus norvegicus (rat))	BDBM50045792 (3-[3,4-Dimethyl-1-(4-methyl-pent-4-enyl)-piperidin...) Show SMILES C[C@H]1CN(CCCC(C)=C)CC[C@@]1(C)c1cccc(O)c1 Show InChI InChI=1S/C19H29NO/c1-15(2)7-6-11-20-12-10-19(4,16(3)14-20)17-8-5-9-18(21)13-17/h5,8-9,13,16,21H,1,6-7,10-12,14H2,2-4H3/t16-,19+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards mu-opioid receptor by the displacement of [3H]-Nal in rat brain homogenates				J Med Chem 36: 2842-50 (1993) BindingDB Entry DOI: 10.7270/Q2R78D9W
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50045792 (3-[3,4-Dimethyl-1-(4-methyl-pent-4-enyl)-piperidin...) Show SMILES C[C@H]1CN(CCCC(C)=C)CC[C@@]1(C)c1cccc(O)c1 Show InChI InChI=1S/C19H29NO/c1-15(2)7-6-11-20-12-10-19(4,16(3)14-20)17-8-5-9-18(21)13-17/h5,8-9,13,16,21H,1,6-7,10-12,14H2,2-4H3/t16-,19+/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Lilly Research Laboratories Curated by ChEMBL					Assay Description Binding affinity towards kappa opioid receptor by displacement of [3H]-EKC in guinea pig cortical tissue				J Med Chem 36: 2842-50 (1993) BindingDB Entry DOI: 10.7270/Q2R78D9W
					More data for this Ligand-Target Pair