BDBM50201433 2-(1-carbamimidoylpiperidin-4-yl)-3-mercaptopropanoic acid::CHEMBL245593

SMILES: NC(=N)N1CCC(CC1)C(CS)C(O)=O

InChI Key: InChIKey=NDKUATGVOUGBIH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50201433   

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
Carboxypeptidase B2 isoform A (Homo sapiens (Human))	BDBM50201433 (2-(1-carbamimidoylpiperidin-4-yl)-3-mercaptopropan...) Show SMILES NC(=N)N1CCC(CC1)C(CS)C(O)=O |w:9.10| Show InChI InChI=1S/C9H17N3O2S/c10-9(11)12-3-1-6(2-4-12)7(5-15)8(13)14/h6-7,15H,1-5H2,(H3,10,11)(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of human activated thrombin activatable fibrinolysis inhibitor				Bioorg Med Chem Lett 17: 1349-54 (2007) Article DOI: 10.1016/j.bmcl.2006.11.078 BindingDB Entry DOI: 10.7270/Q2RJ4J5B
					More data for this Ligand-Target Pair
Carboxypeptidase N, catalytic subunit (Homo sapiens (Human))	BDBM50201433 (2-(1-carbamimidoylpiperidin-4-yl)-3-mercaptopropan...) Show SMILES NC(=N)N1CCC(CC1)C(CS)C(O)=O |w:9.10| Show InChI InChI=1S/C9H17N3O2S/c10-9(11)12-3-1-6(2-4-12)7(5-15)8(13)14/h6-7,15H,1-5H2,(H3,10,11)(H,13,14)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of human carboxypeptidase N				Bioorg Med Chem Lett 17: 1349-54 (2007) Article DOI: 10.1016/j.bmcl.2006.11.078 BindingDB Entry DOI: 10.7270/Q2RJ4J5B
					More data for this Ligand-Target Pair
Carboxypeptidase B (Sus scrofa)	BDBM50201433 (2-(1-carbamimidoylpiperidin-4-yl)-3-mercaptopropan...) Show SMILES NC(=N)N1CCC(CC1)C(CS)C(O)=O |w:9.10| Show InChI InChI=1S/C9H17N3O2S/c10-9(11)12-3-1-6(2-4-12)7(5-15)8(13)14/h6-7,15H,1-5H2,(H3,10,11)(H,13,14)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of porcine pancreatic carboxypeptidase B				Bioorg Med Chem Lett 17: 1349-54 (2007) Article DOI: 10.1016/j.bmcl.2006.11.078 BindingDB Entry DOI: 10.7270/Q2RJ4J5B
					More data for this Ligand-Target Pair