BDBM50278842 (R)-(4-(1-amino-2-(2,4,5-trifluorophenyl)ethyl)piperidin-1-yl)(isoquinolin-3-yl)methanone::CHEMBL498749

SMILES: N[C@H](Cc1cc(F)c(F)cc1F)C1CCN(CC1)C(=O)c1cc2ccccc2cn1

InChI Key: InChIKey=ATBDAPSSXMURMK-OAQYLSRUSA-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 = 50278842   

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
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50278842 ((R)-(4-(1-amino-2-(2,4,5-trifluorophenyl)ethyl)pip...) Show SMILES N[C@H](Cc1cc(F)c(F)cc1F)C1CCN(CC1)C(=O)c1cc2ccccc2cn1 |r| Show InChI InChI=1S/C23H22F3N3O/c24-18-12-20(26)19(25)9-17(18)10-21(27)14-5-7-29(8-6-14)23(30)22-11-15-3-1-2-4-16(15)13-28-22/h1-4,9,11-14,21H,5-8,10,27H2/t21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.02E+7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of human DPP2				Bioorg Med Chem Lett 19: 2220-3 (2009) Article DOI: 10.1016/j.bmcl.2009.02.099 BindingDB Entry DOI: 10.7270/Q2RN37QF
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50278842 ((R)-(4-(1-amino-2-(2,4,5-trifluorophenyl)ethyl)pip...) Show SMILES N[C@H](Cc1cc(F)c(F)cc1F)C1CCN(CC1)C(=O)c1cc2ccccc2cn1 |r| Show InChI InChI=1S/C23H22F3N3O/c24-18-12-20(26)19(25)9-17(18)10-21(27)14-5-7-29(8-6-14)23(30)22-11-15-3-1-2-4-16(15)13-28-22/h1-4,9,11-14,21H,5-8,10,27H2/t21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of human DPP4				Bioorg Med Chem Lett 19: 2220-3 (2009) Article DOI: 10.1016/j.bmcl.2009.02.099 BindingDB Entry DOI: 10.7270/Q2RN37QF
					More data for this Ligand-Target Pair