BDBM50461631 CHEMBL4225490
SMILES: C=CC(=O)NCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)N1CCN(CC1)c1ccccn1
InChI Key: InChIKey=BUCCIVVOBDOGDI-QFIPXVFZSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Protein-glutamine gamma-glutamyltransferase (Homo sapiens (Human)) | BDBM50461631 (CHEMBL4225490) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 8.42E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Helmholtz-Zentrum Dresden-Rossendorf Curated by ChEMBL | Assay Description Reversible inhibition of human TGase 2 using Z-Glu(HMC)-Gly-OH as substrate measured at 20 secs interval over 900 secs by fluorimetric assay | J Med Chem 61: 4528-4560 (2018) Article DOI: 10.1021/acs.jmedchem.8b00286 BindingDB Entry DOI: 10.7270/Q2W66PC7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protein-glutamine gamma-glutamyltransferase (Homo sapiens (Human)) | BDBM50461631 (CHEMBL4225490) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Helmholtz-Zentrum Dresden-Rossendorf Curated by ChEMBL | Assay Description Inhibition of human TGase 2 using R-I-Cad/DMC as substrate preincubated for 5 mins followed by substrate addition measured at 30 secs interval over 9... | J Med Chem 61: 4528-4560 (2018) Article DOI: 10.1021/acs.jmedchem.8b00286 BindingDB Entry DOI: 10.7270/Q2W66PC7 | |||||||||||
More data for this Ligand-Target Pair |