BDBM50375237 CHEMBL272114
SMILES: Cn1cnc2cc(C#N)c(c(CN)c12)-c1ccccc1Cl
InChI Key: InChIKey=YJLVMTVZVJSNHG-UHFFFAOYSA-N
Data: 3 IC50
PDB links: 1 PDB ID matches this monomer.
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 3 hits for monomerid = 50375237 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 VIII
(Homo sapiens (Human)) | BDBM50375237
 (CHEMBL272114)Show InChI InChI=1S/C16H13ClN4/c1-21-9-20-14-6-10(7-18)15(12(8-19)16(14)21)11-4-2-3-5-13(11)17/h2-6,9H,8,19H2,1H3 | PDB
KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
antibodypedia GoogleScholar
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda California Inc
Curated by ChEMBL
| Assay Description Inhibition of DPP8 |
Bioorg Med Chem Lett 18: 2362-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.071 BindingDB Entry DOI: 10.7270/Q29P32GJ |
More data for this Ligand-Target Pair | |
Dipeptidyl peptidase II and dipeptidyl peptidase IV (DPP2 and DPP4)
(Homo sapiens (Human)) | BDBM50375237
 (CHEMBL272114)Show InChI InChI=1S/C16H13ClN4/c1-21-9-20-14-6-10(7-18)15(12(8-19)16(14)21)11-4-2-3-5-13(11)17/h2-6,9H,8,19H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| MMDB PDB
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description Inhibition of dipeptidyl peptidase 4 (unknown origin) |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2HH6NZ4 |
More data for this Ligand-Target Pair |  3D Structure (crystal) |
Dipeptidyl peptidase 4
(Homo sapiens (Human)) | BDBM50375237
 (CHEMBL272114)Show InChI InChI=1S/C16H13ClN4/c1-21-9-20-14-6-10(7-18)15(12(8-19)16(14)21)11-4-2-3-5-13(11)17/h2-6,9H,8,19H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| MMDB PDB Article PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda California Inc
Curated by ChEMBL
| Assay Description Inhibition of human DPP4 |
Bioorg Med Chem Lett 18: 2362-7 (2008)
Article DOI: 10.1016/j.bmcl.2008.02.071 BindingDB Entry DOI: 10.7270/Q29P32GJ |
More data for this Ligand-Target Pair |  3D Structure (crystal) |