BDBM50338450 CHEMBL1682984::trans-N-(4-((R)-1-amino-2-(2,5-difluorophenyl)ethyl)cyclohexyl)-N-methyl-4-(oxazol-5-yl)benzenesulfonamide

SMILES: CN([C@H]1CC[C@@H](CC1)[C@H](N)Cc1cc(F)ccc1F)S(=O)(=O)c1ccc(cc1)-c1cnco1

InChI Key: InChIKey=JDYTXELXHKVAIL-AYPBNUJASA-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 = 50338450   

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))	BDBM50338450 (CHEMBL1682984 | 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)c1ccc(cc1)-c1cnco1 |r,wU:8.9,2.1,wD:5.4,(.18,-28.73,;.18,-27.19,;-1.15,-26.42,;-2.49,-27.18,;-3.81,-26.41,;-3.81,-24.88,;-2.48,-24.1,;-1.15,-24.88,;-5.14,-24.11,;-5.14,-22.57,;-6.47,-24.88,;-7.81,-24.11,;-7.82,-22.56,;-9.15,-21.8,;-9.16,-20.26,;-10.48,-22.57,;-10.48,-24.12,;-9.15,-24.89,;-9.15,-26.43,;1.52,-26.42,;.42,-25.32,;2.28,-25.08,;2.85,-27.2,;2.84,-28.73,;4.17,-29.51,;5.51,-28.74,;5.5,-27.19,;4.17,-26.42,;6.84,-29.51,;7,-31.04,;8.51,-31.36,;9.28,-30.03,;8.25,-28.88,)| Show InChI InChI=1S/C24H27F2N3O3S/c1-29(33(30,31)21-9-4-17(5-10-21)24-14-28-15-32-24)20-7-2-16(3-8-20)23(27)13-18-12-19(25)6-11-22(18)26/h4-6,9-12,14-16,20,23H,2-3,7-8,13,27H2,1H3/t16-,20-,23-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	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))	BDBM50338450 (CHEMBL1682984 | 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)c1ccc(cc1)-c1cnco1 |r,wU:8.9,2.1,wD:5.4,(.18,-28.73,;.18,-27.19,;-1.15,-26.42,;-2.49,-27.18,;-3.81,-26.41,;-3.81,-24.88,;-2.48,-24.1,;-1.15,-24.88,;-5.14,-24.11,;-5.14,-22.57,;-6.47,-24.88,;-7.81,-24.11,;-7.82,-22.56,;-9.15,-21.8,;-9.16,-20.26,;-10.48,-22.57,;-10.48,-24.12,;-9.15,-24.89,;-9.15,-26.43,;1.52,-26.42,;.42,-25.32,;2.28,-25.08,;2.85,-27.2,;2.84,-28.73,;4.17,-29.51,;5.51,-28.74,;5.5,-27.19,;4.17,-26.42,;6.84,-29.51,;7,-31.04,;8.51,-31.36,;9.28,-30.03,;8.25,-28.88,)| Show InChI InChI=1S/C24H27F2N3O3S/c1-29(33(30,31)21-9-4-17(5-10-21)24-14-28-15-32-24)20-7-2-16(3-8-20)23(27)13-18-12-19(25)6-11-22(18)26/h4-6,9-12,14-16,20,23H,2-3,7-8,13,27H2,1H3/t16-,20-,23-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.30E+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
Dipeptidyl peptidase 9 (Homo sapiens (Human))	BDBM50338450 (CHEMBL1682984 | 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)c1ccc(cc1)-c1cnco1 |r,wU:8.9,2.1,wD:5.4,(.18,-28.73,;.18,-27.19,;-1.15,-26.42,;-2.49,-27.18,;-3.81,-26.41,;-3.81,-24.88,;-2.48,-24.1,;-1.15,-24.88,;-5.14,-24.11,;-5.14,-22.57,;-6.47,-24.88,;-7.81,-24.11,;-7.82,-22.56,;-9.15,-21.8,;-9.16,-20.26,;-10.48,-22.57,;-10.48,-24.12,;-9.15,-24.89,;-9.15,-26.43,;1.52,-26.42,;.42,-25.32,;2.28,-25.08,;2.85,-27.2,;2.84,-28.73,;4.17,-29.51,;5.51,-28.74,;5.5,-27.19,;4.17,-26.42,;6.84,-29.51,;7,-31.04,;8.51,-31.36,;9.28,-30.03,;8.25,-28.88,)| Show InChI InChI=1S/C24H27F2N3O3S/c1-29(33(30,31)21-9-4-17(5-10-21)24-14-28-15-32-24)20-7-2-16(3-8-20)23(27)13-18-12-19(25)6-11-22(18)26/h4-6,9-12,14-16,20,23H,2-3,7-8,13,27H2,1H3/t16-,20-,23-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+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))	BDBM50338450 (CHEMBL1682984 | 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)c1ccc(cc1)-c1cnco1 |r,wU:8.9,2.1,wD:5.4,(.18,-28.73,;.18,-27.19,;-1.15,-26.42,;-2.49,-27.18,;-3.81,-26.41,;-3.81,-24.88,;-2.48,-24.1,;-1.15,-24.88,;-5.14,-24.11,;-5.14,-22.57,;-6.47,-24.88,;-7.81,-24.11,;-7.82,-22.56,;-9.15,-21.8,;-9.16,-20.26,;-10.48,-22.57,;-10.48,-24.12,;-9.15,-24.89,;-9.15,-26.43,;1.52,-26.42,;.42,-25.32,;2.28,-25.08,;2.85,-27.2,;2.84,-28.73,;4.17,-29.51,;5.51,-28.74,;5.5,-27.19,;4.17,-26.42,;6.84,-29.51,;7,-31.04,;8.51,-31.36,;9.28,-30.03,;8.25,-28.88,)| Show InChI InChI=1S/C24H27F2N3O3S/c1-29(33(30,31)21-9-4-17(5-10-21)24-14-28-15-32-24)20-7-2-16(3-8-20)23(27)13-18-12-19(25)6-11-22(18)26/h4-6,9-12,14-16,20,23H,2-3,7-8,13,27H2,1H3/t16-,20-,23-/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	130	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))	BDBM50338450 (CHEMBL1682984 | 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)c1ccc(cc1)-c1cnco1 |r,wU:8.9,2.1,wD:5.4,(.18,-28.73,;.18,-27.19,;-1.15,-26.42,;-2.49,-27.18,;-3.81,-26.41,;-3.81,-24.88,;-2.48,-24.1,;-1.15,-24.88,;-5.14,-24.11,;-5.14,-22.57,;-6.47,-24.88,;-7.81,-24.11,;-7.82,-22.56,;-9.15,-21.8,;-9.16,-20.26,;-10.48,-22.57,;-10.48,-24.12,;-9.15,-24.89,;-9.15,-26.43,;1.52,-26.42,;.42,-25.32,;2.28,-25.08,;2.85,-27.2,;2.84,-28.73,;4.17,-29.51,;5.51,-28.74,;5.5,-27.19,;4.17,-26.42,;6.84,-29.51,;7,-31.04,;8.51,-31.36,;9.28,-30.03,;8.25,-28.88,)| Show InChI InChI=1S/C24H27F2N3O3S/c1-29(33(30,31)21-9-4-17(5-10-21)24-14-28-15-32-24)20-7-2-16(3-8-20)23(27)13-18-12-19(25)6-11-22(18)26/h4-6,9-12,14-16,20,23H,2-3,7-8,13,27H2,1H3/t16-,20-,23-/m1/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.60E+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