BDBM50248654 3-({2-[(2S,4S)-2-Cyano-4-fluoropyrrolidin-1-yl]-2-oxoethyl}amino)-3-methyl-N-[(1S,2R)-2-(4-methoxyphenyl)cyclopropyl]butanamide::CHEMBL463277

SMILES: COc1ccc(cc1)[C@H]1C[C@@H]1NC(=O)CC(C)(C)NCC(=O)N1C[C@@H](F)C[C@H]1C#N

InChI Key: InChIKey=KLUHQYUTDOJTMN-DKKFBQAASA-N

Data: 4 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 4 hits for monomerid = 50248654   

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))	BDBM50248654 (3-({2-[(2S,4S)-2-Cyano-4-fluoropyrrolidin-1-yl]-2-...) Show SMILES COc1ccc(cc1)[C@H]1C[C@@H]1NC(=O)CC(C)(C)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r| Show InChI InChI=1S/C22H29FN4O3/c1-22(2,25-12-21(29)27-13-15(23)8-16(27)11-24)10-20(28)26-19-9-18(19)14-4-6-17(30-3)7-5-14/h4-7,15-16,18-19,25H,8-10,12-13H2,1-3H3,(H,26,28)/t15-,16-,18+,19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of human FAP				Bioorg Med Chem 17: 2388-99 (2009) Article DOI: 10.1016/j.bmc.2009.02.020 BindingDB Entry DOI: 10.7270/Q2416WZS
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 4 (Homo sapiens (Human))	BDBM50248654 (3-({2-[(2S,4S)-2-Cyano-4-fluoropyrrolidin-1-yl]-2-...) Show SMILES COc1ccc(cc1)[C@H]1C[C@@H]1NC(=O)CC(C)(C)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r| Show InChI InChI=1S/C22H29FN4O3/c1-22(2,25-12-21(29)27-13-15(23)8-16(27)11-24)10-20(28)26-19-9-18(19)14-4-6-17(30-3)7-5-14/h4-7,15-16,18-19,25H,8-10,12-13H2,1-3H3,(H,26,28)/t15-,16-,18+,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of human DPP4				Bioorg Med Chem 17: 2388-99 (2009) Article DOI: 10.1016/j.bmc.2009.02.020 BindingDB Entry DOI: 10.7270/Q2416WZS
					More data for this Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II) (Homo sapiens (Human))	BDBM50248654 (3-({2-[(2S,4S)-2-Cyano-4-fluoropyrrolidin-1-yl]-2-...) Show SMILES COc1ccc(cc1)[C@H]1C[C@@H]1NC(=O)CC(C)(C)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r| Show InChI InChI=1S/C22H29FN4O3/c1-22(2,25-12-21(29)27-13-15(23)8-16(27)11-24)10-20(28)26-19-9-18(19)14-4-6-17(30-3)7-5-14/h4-7,15-16,18-19,25H,8-10,12-13H2,1-3H3,(H,26,28)/t15-,16-,18+,19-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of human DPP2				Bioorg Med Chem 17: 2388-99 (2009) Article DOI: 10.1016/j.bmc.2009.02.020 BindingDB Entry DOI: 10.7270/Q2416WZS
					More data for this Ligand-Target Pair
Dipeptidyl peptidase VIII (Homo sapiens (Human))	BDBM50248654 (3-({2-[(2S,4S)-2-Cyano-4-fluoropyrrolidin-1-yl]-2-...) Show SMILES COc1ccc(cc1)[C@H]1C[C@@H]1NC(=O)CC(C)(C)NCC(=O)N1C[C@@H](F)C[C@H]1C#N |r| Show InChI InChI=1S/C22H29FN4O3/c1-22(2,25-12-21(29)27-13-15(23)8-16(27)11-24)10-20(28)26-19-9-18(19)14-4-6-17(30-3)7-5-14/h4-7,15-16,18-19,25H,8-10,12-13H2,1-3H3,(H,26,28)/t15-,16-,18+,19-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
National Health Research Institutes Curated by ChEMBL					Assay Description Inhibition of human DPP8				Bioorg Med Chem 17: 2388-99 (2009) Article DOI: 10.1016/j.bmc.2009.02.020 BindingDB Entry DOI: 10.7270/Q2416WZS
					More data for this Ligand-Target Pair