null

SMILES: O=C(CCc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)OCc1ccccc1)[CH-][N+]#N

InChI Key: InChIKey=QTBLGGCZUQOLHI-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50420498   

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 2 (Homo sapiens (Human))	BDBM50420498 (CHEMBL2086499) Show SMILES O=C(CCc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)OCc1ccccc1)[CH-][N+]#N Show InChI InChI=1S/C22H24N4O5S/c23-24-16-20(27)9-6-18-7-10-21(11-8-18)32(29,30)26-14-12-25(13-15-26)22(28)31-17-19-4-2-1-3-5-19/h1-5,7-8,10-11,16H,6,9,12-15,17H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Evotec (UK) Ltd. Curated by ChEMBL					Assay Description Inhibition of human recombinant TG2 by fluorescent transamidation assay				J Med Chem 55: 1021-46 (2012) Article DOI: 10.1021/jm201310y BindingDB Entry DOI: 10.7270/Q2CN7560
					More data for this Ligand-Target Pair
Coagulation factor XIII A chain (Homo sapiens (Human))	BDBM50420498 (CHEMBL2086499) Show SMILES O=C(CCc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)OCc1ccccc1)[CH-][N+]#N Show InChI InChI=1S/C22H24N4O5S/c23-24-16-20(27)9-6-18-7-10-21(11-8-18)32(29,30)26-14-12-25(13-15-26)22(28)31-17-19-4-2-1-3-5-19/h1-5,7-8,10-11,16H,6,9,12-15,17H2	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	4.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Evotec (UK) Ltd. Curated by ChEMBL					Assay Description Inhibition of thrombin activated human F13a by fluorescent transamidation assay				J Med Chem 55: 1021-46 (2012) Article DOI: 10.1021/jm201310y BindingDB Entry DOI: 10.7270/Q2CN7560
					More data for this Ligand-Target Pair
Protein-glutamine gamma-glutamyltransferase K (Homo sapiens (Human))	BDBM50420498 (CHEMBL2086499) Show SMILES O=C(CCc1ccc(cc1)S(=O)(=O)N1CCN(CC1)C(=O)OCc1ccccc1)[CH-][N+]#N Show InChI InChI=1S/C22H24N4O5S/c23-24-16-20(27)9-6-18-7-10-21(11-8-18)32(29,30)26-14-12-25(13-15-26)22(28)31-17-19-4-2-1-3-5-19/h1-5,7-8,10-11,16H,6,9,12-15,17H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Evotec (UK) Ltd. Curated by ChEMBL					Assay Description Inhibition of human recombinant TG1 by fluorescent transamidation assay				J Med Chem 55: 1021-46 (2012) Article DOI: 10.1021/jm201310y BindingDB Entry DOI: 10.7270/Q2CN7560
					More data for this Ligand-Target Pair