BDBM50338441 CHEMBL1682975::trans-N-(4-((R)-1-amino-2-(2,5-difluorophenyl)ethyl)cyclohexyl)-N-methylbenzenesulfonamide

SMILES: CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1

InChI Key: InChIKey=PYXREBXMIVNEAI-FQELHTAISA-N

Data: 5 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 5 hits for monomerid = 50338441   

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
Fibroblast activation protein alpha (Homo sapiens (Human))	BDBM50338441 (CHEMBL1682975 | trans-N-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1 |r,wU:8.9,2.1,wD:5.5,(17.38,-2.57,;17.38,-1.03,;16.05,-.25,;14.71,-1.02,;13.38,-.25,;13.39,1.29,;14.71,2.07,;16.05,1.29,;12.05,2.05,;12.05,3.59,;10.72,1.28,;9.39,2.05,;9.38,3.6,;8.05,4.36,;8.04,5.9,;6.72,3.59,;6.72,2.05,;8.05,1.28,;8.05,-.26,;18.72,-.26,;17.94,1.08,;19.48,1.08,;20.04,-1.03,;20.04,-2.56,;21.36,-3.33,;22.69,-2.57,;22.69,-1.02,;21.36,-.26,)| Show InChI InChI=1S/C21H26F2N2O2S/c1-25(28(26,27)19-5-3-2-4-6-19)18-10-7-15(8-11-18)21(24)14-16-13-17(22)9-12-20(16)23/h2-6,9,12-13,15,18,21H,7-8,10-11,14,24H2,1H3/t15-,18-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of FAP				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase VIII (Homo sapiens (Human))	BDBM50338441 (CHEMBL1682975 | trans-N-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1 |r,wU:8.9,2.1,wD:5.5,(17.38,-2.57,;17.38,-1.03,;16.05,-.25,;14.71,-1.02,;13.38,-.25,;13.39,1.29,;14.71,2.07,;16.05,1.29,;12.05,2.05,;12.05,3.59,;10.72,1.28,;9.39,2.05,;9.38,3.6,;8.05,4.36,;8.04,5.9,;6.72,3.59,;6.72,2.05,;8.05,1.28,;8.05,-.26,;18.72,-.26,;17.94,1.08,;19.48,1.08,;20.04,-1.03,;20.04,-2.56,;21.36,-3.33,;22.69,-2.57,;22.69,-1.02,;21.36,-.26,)| Show InChI InChI=1S/C21H26F2N2O2S/c1-25(28(26,27)19-5-3-2-4-6-19)18-10-7-15(8-11-18)21(24)14-16-13-17(22)9-12-20(16)23/h2-6,9,12-13,15,18,21H,7-8,10-11,14,24H2,1H3/t15-,18-,21-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of DPP8				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50338441 (CHEMBL1682975 | trans-N-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1 |r,wU:8.9,2.1,wD:5.5,(17.38,-2.57,;17.38,-1.03,;16.05,-.25,;14.71,-1.02,;13.38,-.25,;13.39,1.29,;14.71,2.07,;16.05,1.29,;12.05,2.05,;12.05,3.59,;10.72,1.28,;9.39,2.05,;9.38,3.6,;8.05,4.36,;8.04,5.9,;6.72,3.59,;6.72,2.05,;8.05,1.28,;8.05,-.26,;18.72,-.26,;17.94,1.08,;19.48,1.08,;20.04,-1.03,;20.04,-2.56,;21.36,-3.33,;22.69,-2.57,;22.69,-1.02,;21.36,-.26,)| Show InChI InChI=1S/C21H26F2N2O2S/c1-25(28(26,27)19-5-3-2-4-6-19)18-10-7-15(8-11-18)21(24)14-16-13-17(22)9-12-20(16)23/h2-6,9,12-13,15,18,21H,7-8,10-11,14,24H2,1H3/t15-,18-,21-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of DPP9				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50338441 (CHEMBL1682975 | trans-N-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1 |r,wU:8.9,2.1,wD:5.5,(17.38,-2.57,;17.38,-1.03,;16.05,-.25,;14.71,-1.02,;13.38,-.25,;13.39,1.29,;14.71,2.07,;16.05,1.29,;12.05,2.05,;12.05,3.59,;10.72,1.28,;9.39,2.05,;9.38,3.6,;8.05,4.36,;8.04,5.9,;6.72,3.59,;6.72,2.05,;8.05,1.28,;8.05,-.26,;18.72,-.26,;17.94,1.08,;19.48,1.08,;20.04,-1.03,;20.04,-2.56,;21.36,-3.33,;22.69,-2.57,;22.69,-1.02,;21.36,-.26,)| Show InChI InChI=1S/C21H26F2N2O2S/c1-25(28(26,27)19-5-3-2-4-6-19)18-10-7-15(8-11-18)21(24)14-16-13-17(22)9-12-20(16)23/h2-6,9,12-13,15,18,21H,7-8,10-11,14,24H2,1H3/t15-,18-,21-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of DPP4				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50338441 (CHEMBL1682975 | trans-N-(4-((R)-1-amino-2-(2,5-dif...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccccc1 |r,wU:8.9,2.1,wD:5.5,(17.38,-2.57,;17.38,-1.03,;16.05,-.25,;14.71,-1.02,;13.38,-.25,;13.39,1.29,;14.71,2.07,;16.05,1.29,;12.05,2.05,;12.05,3.59,;10.72,1.28,;9.39,2.05,;9.38,3.6,;8.05,4.36,;8.04,5.9,;6.72,3.59,;6.72,2.05,;8.05,1.28,;8.05,-.26,;18.72,-.26,;17.94,1.08,;19.48,1.08,;20.04,-1.03,;20.04,-2.56,;21.36,-3.33,;22.69,-2.57,;22.69,-1.02,;21.36,-.26,)| Show InChI InChI=1S/C21H26F2N2O2S/c1-25(28(26,27)19-5-3-2-4-6-19)18-10-7-15(8-11-18)21(24)14-16-13-17(22)9-12-20(16)23/h2-6,9,12-13,15,18,21H,7-8,10-11,14,24H2,1H3/t15-,18-,21-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of QPP				Bioorg Med Chem Lett 21: 1880-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.060 BindingDB Entry DOI: 10.7270/Q2SX6DJG
					More data for this Ligand-Target Pair