BDBM50172195 ((1S,4aS,10aR)-1,4a-Dimethyl-1,2,3,4,4a,9,10,10a-octahydro-phenanthren-1-yl)-(4-phenyl-piperidin-1-yl)-methanone::CHEMBL194733

SMILES: C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1

InChI Key: InChIKey=ZJPIFOVRFHBVNC-KZQOYIJHSA-N

Data: 2 IC50  2 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 = 50172195   

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
Oxysterols receptor LXR-beta (Homo sapiens (Human))	BDBM50172195 (((1S,4aS,10aR)-1,4a-Dimethyl-1,2,3,4,4a,9,10,10a-o...) Show SMILES C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C28H35NO/c1-27-17-8-18-28(2,25(27)14-13-23-11-6-7-12-24(23)27)26(30)29-19-15-22(16-20-29)21-9-4-3-5-10-21/h3-7,9-12,22,25H,8,13-20H2,1-2H3/t25-,27-,28+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration in recombinant human LXRbeta ligand binding domain in homogeneous time-resolved fluorescence assay				Bioorg Med Chem Lett 15: 4574-8 (2005) Article DOI: 10.1016/j.bmcl.2005.06.100 BindingDB Entry DOI: 10.7270/Q2154GKK
					More data for this Ligand-Target Pair
Oxysterols receptor LXR-alpha (Homo sapiens (Human))	BDBM50172195 (((1S,4aS,10aR)-1,4a-Dimethyl-1,2,3,4,4a,9,10,10a-o...) Show SMILES C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C28H35NO/c1-27-17-8-18-28(2,25(27)14-13-23-11-6-7-12-24(23)27)26(30)29-19-15-22(16-20-29)21-9-4-3-5-10-21/h3-7,9-12,22,25H,8,13-20H2,1-2H3/t25-,27-,28+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	70	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Effective concentration in transactivation assay using a chimeric LXR construct in HEK293 cells for LXRalpha receptor				Bioorg Med Chem Lett 15: 4574-8 (2005) Article DOI: 10.1016/j.bmcl.2005.06.100 BindingDB Entry DOI: 10.7270/Q2154GKK
					More data for this Ligand-Target Pair
Oxysterols receptor LXR-alpha (Homo sapiens (Human))	BDBM50172195 (((1S,4aS,10aR)-1,4a-Dimethyl-1,2,3,4,4a,9,10,10a-o...) Show SMILES C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C28H35NO/c1-27-17-8-18-28(2,25(27)14-13-23-11-6-7-12-24(23)27)26(30)29-19-15-22(16-20-29)21-9-4-3-5-10-21/h3-7,9-12,22,25H,8,13-20H2,1-2H3/t25-,27-,28+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory concentration in LXRSPA alpha binding assay				Bioorg Med Chem Lett 15: 4574-8 (2005) Article DOI: 10.1016/j.bmcl.2005.06.100 BindingDB Entry DOI: 10.7270/Q2154GKK
					More data for this Ligand-Target Pair
Oxysterols receptor LXR-beta (Homo sapiens (Human))	BDBM50172195 (((1S,4aS,10aR)-1,4a-Dimethyl-1,2,3,4,4a,9,10,10a-o...) Show SMILES C[C@@]1(CCC[C@@]2(C)[C@H]1CCc1ccccc21)C(=O)N1CCC(CC1)c1ccccc1 Show InChI InChI=1S/C28H35NO/c1-27-17-8-18-28(2,25(27)14-13-23-11-6-7-12-24(23)27)26(30)29-19-15-22(16-20-29)21-9-4-3-5-10-21/h3-7,9-12,22,25H,8,13-20H2,1-2H3/t25-,27-,28+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibitory concentration in LXRSPA beta binding assay				Bioorg Med Chem Lett 15: 4574-8 (2005) Article DOI: 10.1016/j.bmcl.2005.06.100 BindingDB Entry DOI: 10.7270/Q2154GKK
					More data for this Ligand-Target Pair