BDBM50484311 CHEMBL1837057

SMILES: Cc1cnc(s1)C1CC2Cc3[nH]ncc3C(C1)N2S(=O)(=O)c1ccc(nc1)C(F)(F)F

InChI Key: InChIKey=LFEROJSQMPEGCL-UHFFFAOYSA-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 = 50484311   

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
Presenilin-1 (Homo sapiens (Human))	BDBM50484311 (CHEMBL1837057) Show SMILES Cc1cnc(s1)C1CC2Cc3[nH]ncc3C(C1)N2S(=O)(=O)c1ccc(nc1)C(F)(F)F |THB:18:17:7.16.6:9.14.10| Show InChI InChI=1S/C19H18F3N5O2S2/c1-10-7-24-18(30-10)11-4-12-6-15-14(9-25-26-15)16(5-11)27(12)31(28,29)13-2-3-17(23-8-13)19(20,21)22/h2-3,7-9,11-12,16H,4-6H2,1H3,(H,25,26)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of gamma-secretase-mediated notch cleavage in human SNC-204B8 cells after 16 hrs by luciferase reporter gene assay				Bioorg Med Chem Lett 21: 5791-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.008 BindingDB Entry DOI: 10.7270/Q27M0BSF
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50484311 (CHEMBL1837057) Show SMILES Cc1cnc(s1)C1CC2Cc3[nH]ncc3C(C1)N2S(=O)(=O)c1ccc(nc1)C(F)(F)F |THB:18:17:7.16.6:9.14.10| Show InChI InChI=1S/C19H18F3N5O2S2/c1-10-7-24-18(30-10)11-4-12-6-15-14(9-25-26-15)16(5-11)27(12)31(28,29)13-2-3-17(23-8-13)19(20,21)22/h2-3,7-9,11-12,16H,4-6H2,1H3,(H,25,26)	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	149	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of gamma-secretase-mediated cleavage of amyloid precursor protein in human IMR32 cells after 2 hrs using MBPC-125 substrate by ELISA assay				Bioorg Med Chem Lett 21: 5791-4 (2011) Article DOI: 10.1016/j.bmcl.2011.08.008 BindingDB Entry DOI: 10.7270/Q27M0BSF
					More data for this Ligand-Target Pair