BDBM50338469 CHEMBL1683103::trans-4-((4-((R)-1-amino-2-(2,5-difluorophenyl)ethyl)cyclohexyl)(methyl)amino)-4-oxobutanoic acid

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

InChI Key: InChIKey=LURBQPNARFKMJP-SRCQZFHVSA-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 = 50338469   

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))	BDBM50338469 (CHEMBL1683103 | trans-4-((4-((R)-1-amino-2-(2,5-di...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)C(=O)CCC(O)=O |r,wU:8.9,2.1,wD:5.5,(52.14,-13.08,;52.14,-11.54,;50.81,-10.77,;49.47,-11.53,;48.14,-10.77,;48.15,-9.23,;49.47,-8.45,;50.81,-9.23,;46.81,-8.46,;46.81,-6.92,;45.48,-9.23,;44.15,-8.47,;44.14,-6.92,;42.81,-6.15,;42.8,-4.61,;41.48,-6.92,;41.47,-8.47,;42.81,-9.24,;42.81,-10.78,;53.47,-10.77,;53.48,-9.23,;54.81,-11.55,;56.14,-10.78,;57.47,-11.55,;57.47,-13.09,;58.81,-10.79,)| Show InChI InChI=1S/C19H26F2N2O3/c1-23(18(24)8-9-19(25)26)15-5-2-12(3-6-15)17(22)11-13-10-14(20)4-7-16(13)21/h4,7,10,12,15,17H,2-3,5-6,8-9,11,22H2,1H3,(H,25,26)/t12-,15-,17-/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 2 (DPP II) (Homo sapiens (Human))	BDBM50338469 (CHEMBL1683103 | trans-4-((4-((R)-1-amino-2-(2,5-di...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)C(=O)CCC(O)=O |r,wU:8.9,2.1,wD:5.5,(52.14,-13.08,;52.14,-11.54,;50.81,-10.77,;49.47,-11.53,;48.14,-10.77,;48.15,-9.23,;49.47,-8.45,;50.81,-9.23,;46.81,-8.46,;46.81,-6.92,;45.48,-9.23,;44.15,-8.47,;44.14,-6.92,;42.81,-6.15,;42.8,-4.61,;41.48,-6.92,;41.47,-8.47,;42.81,-9.24,;42.81,-10.78,;53.47,-10.77,;53.48,-9.23,;54.81,-11.55,;56.14,-10.78,;57.47,-11.55,;57.47,-13.09,;58.81,-10.79,)| Show InChI InChI=1S/C19H26F2N2O3/c1-23(18(24)8-9-19(25)26)15-5-2-12(3-6-15)17(22)11-13-10-14(20)4-7-16(13)21/h4,7,10,12,15,17H,2-3,5-6,8-9,11,22H2,1H3,(H,25,26)/t12-,15-,17-/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	>1.00E+5	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
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50338469 (CHEMBL1683103 | trans-4-((4-((R)-1-amino-2-(2,5-di...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)C(=O)CCC(O)=O |r,wU:8.9,2.1,wD:5.5,(52.14,-13.08,;52.14,-11.54,;50.81,-10.77,;49.47,-11.53,;48.14,-10.77,;48.15,-9.23,;49.47,-8.45,;50.81,-9.23,;46.81,-8.46,;46.81,-6.92,;45.48,-9.23,;44.15,-8.47,;44.14,-6.92,;42.81,-6.15,;42.8,-4.61,;41.48,-6.92,;41.47,-8.47,;42.81,-9.24,;42.81,-10.78,;53.47,-10.77,;53.48,-9.23,;54.81,-11.55,;56.14,-10.78,;57.47,-11.55,;57.47,-13.09,;58.81,-10.79,)| Show InChI InChI=1S/C19H26F2N2O3/c1-23(18(24)8-9-19(25)26)15-5-2-12(3-6-15)17(22)11-13-10-14(20)4-7-16(13)21/h4,7,10,12,15,17H,2-3,5-6,8-9,11,22H2,1H3,(H,25,26)/t12-,15-,17-/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 VIII (Homo sapiens (Human))	BDBM50338469 (CHEMBL1683103 | trans-4-((4-((R)-1-amino-2-(2,5-di...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)C(=O)CCC(O)=O |r,wU:8.9,2.1,wD:5.5,(52.14,-13.08,;52.14,-11.54,;50.81,-10.77,;49.47,-11.53,;48.14,-10.77,;48.15,-9.23,;49.47,-8.45,;50.81,-9.23,;46.81,-8.46,;46.81,-6.92,;45.48,-9.23,;44.15,-8.47,;44.14,-6.92,;42.81,-6.15,;42.8,-4.61,;41.48,-6.92,;41.47,-8.47,;42.81,-9.24,;42.81,-10.78,;53.47,-10.77,;53.48,-9.23,;54.81,-11.55,;56.14,-10.78,;57.47,-11.55,;57.47,-13.09,;58.81,-10.79,)| Show InChI InChI=1S/C19H26F2N2O3/c1-23(18(24)8-9-19(25)26)15-5-2-12(3-6-15)17(22)11-13-10-14(20)4-7-16(13)21/h4,7,10,12,15,17H,2-3,5-6,8-9,11,22H2,1H3,(H,25,26)/t12-,15-,17-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	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))	BDBM50338469 (CHEMBL1683103 | trans-4-((4-((R)-1-amino-2-(2,5-di...) Show SMILES CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)C(=O)CCC(O)=O |r,wU:8.9,2.1,wD:5.5,(52.14,-13.08,;52.14,-11.54,;50.81,-10.77,;49.47,-11.53,;48.14,-10.77,;48.15,-9.23,;49.47,-8.45,;50.81,-9.23,;46.81,-8.46,;46.81,-6.92,;45.48,-9.23,;44.15,-8.47,;44.14,-6.92,;42.81,-6.15,;42.8,-4.61,;41.48,-6.92,;41.47,-8.47,;42.81,-9.24,;42.81,-10.78,;53.47,-10.77,;53.48,-9.23,;54.81,-11.55,;56.14,-10.78,;57.47,-11.55,;57.47,-13.09,;58.81,-10.79,)| Show InChI InChI=1S/C19H26F2N2O3/c1-23(18(24)8-9-19(25)26)15-5-2-12(3-6-15)17(22)11-13-10-14(20)4-7-16(13)21/h4,7,10,12,15,17H,2-3,5-6,8-9,11,22H2,1H3,(H,25,26)/t12-,15-,17-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	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