BDBM50061975 CHEMBL3394229

SMILES: Cc1cc2CC\C=C\Cc3c(O[C@H]4CC[C@H](N)CC4)cc(Cl)cc3C(=O)NCc2c(=O)[nH]1

InChI Key: InChIKey=UGABIBYFHYMJLY-SFWBYWLOSA-N

Data: 2 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 2 hits for monomerid = 50061975   

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
Histone-lysine N-methyltransferase EZH2 (Homo sapiens (Human))	BDBM50061975 (CHEMBL3394229) Show SMILES Cc1cc2CC\C=C\Cc3c(O[C@H]4CC[C@H](N)CC4)cc(Cl)cc3C(=O)NCc2c(=O)[nH]1 |r,wU:12.11,wD:15.15,t:6,(6.34,-.86,;5.12,-.66,;4.14,-1.85,;2.63,-1.6,;1.78,-2.88,;.28,-3.15,;-.93,-2.21,;-.84,-.68,;-2.18,.02,;-2.72,1.46,;-4.26,1.53,;-5.09,.23,;-6.63,.31,;-7.46,-.99,;-9,-.91,;-9.7,.46,;-10.93,.52,;-8.87,1.75,;-7.33,1.68,;-4.97,2.9,;-4.14,4.19,;-4.7,5.29,;-2.6,4.13,;-1.89,2.76,;-.34,2.93,;.08,4.09,;.77,1.82,;.59,.29,;2.08,-.15,;3.06,1.04,;2.63,2.19,;4.58,.78,)| Show InChI InChI=1S/C25H30ClN3O3/c1-15-11-16-5-3-2-4-6-20-21(24(30)28-14-22(16)25(31)29-15)12-17(26)13-23(20)32-19-9-7-18(27)8-10-19/h2,4,11-13,18-19H,3,5-10,14,27H2,1H3,(H,28,30)(H,29,31)/b4-2+/t18-,19-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of methyltransferase activity of EZH2 within human PRC2 complex expressed in Sf9 cells assessed as transfer of tritiated methyl group from...				ACS Med Chem Lett 6: 108-9 (2015) Article DOI: 10.1021/ml5005377 BindingDB Entry DOI: 10.7270/Q27W6DV6
					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2 (Homo sapiens (Human))	BDBM50061975 (CHEMBL3394229) Show SMILES Cc1cc2CC\C=C\Cc3c(O[C@H]4CC[C@H](N)CC4)cc(Cl)cc3C(=O)NCc2c(=O)[nH]1 |r,wU:12.11,wD:15.15,t:6,(6.34,-.86,;5.12,-.66,;4.14,-1.85,;2.63,-1.6,;1.78,-2.88,;.28,-3.15,;-.93,-2.21,;-.84,-.68,;-2.18,.02,;-2.72,1.46,;-4.26,1.53,;-5.09,.23,;-6.63,.31,;-7.46,-.99,;-9,-.91,;-9.7,.46,;-10.93,.52,;-8.87,1.75,;-7.33,1.68,;-4.97,2.9,;-4.14,4.19,;-4.7,5.29,;-2.6,4.13,;-1.89,2.76,;-.34,2.93,;.08,4.09,;.77,1.82,;.59,.29,;2.08,-.15,;3.06,1.04,;2.63,2.19,;4.58,.78,)| Show InChI InChI=1S/C25H30ClN3O3/c1-15-11-16-5-3-2-4-6-20-21(24(30)28-14-22(16)25(31)29-15)12-17(26)13-23(20)32-19-9-7-18(27)8-10-19/h2,4,11-13,18-19H,3,5-10,14,27H2,1H3,(H,28,30)(H,29,31)/b4-2+/t18-,19-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of methyltransferase activity of EZH2 within human PRC2 complex expressed in Sf9 cells assessed as transfer of tritiated methyl group from...				ACS Med Chem Lett 6: 108-9 (2015) Article DOI: 10.1021/ml5005377 BindingDB Entry DOI: 10.7270/Q27W6DV6
					More data for this Ligand-Target Pair