BDBM50020808 CHEMBL1788147::CHEMBL278348::[Indan-2-yl-(3-mercapto-2-methyl-propionyl)-amino]-acetic acid::[Indan-2-yl-(3-mercapto-2-methyl-propionyl)-amino]-acetic acid; Dicyclohexyl amine salt

SMILES: CC(CS)C(=O)N(CC(O)=O)C1Cc2ccccc2C1

InChI Key: InChIKey=KSVRHWYBXURNCF-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50020808   

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
Angiotensin-converting enzyme (Oryctolagus cuniculus)	BDBM50020808 (CHEMBL1788147 | CHEMBL278348 | [Indan-2-yl-(3-merc...) Show SMILES CC(CS)C(=O)N(CC(O)=O)C1Cc2ccccc2C1 Show InChI InChI=1S/C15H19NO3S/c1-10(9-20)15(19)16(8-14(17)18)13-6-11-4-2-3-5-12(11)7-13/h2-5,10,13,20H,6-9H2,1H3,(H,17,18)	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against rabbit lung Angiotensin I converting enzyme at pH 8.3				J Med Chem 28: 57-66 (1985) BindingDB Entry DOI: 10.7270/Q2M90975
					More data for this Ligand-Target Pair
Angiotensin-converting enzyme (Oryctolagus cuniculus)	BDBM50020808 (CHEMBL1788147 | CHEMBL278348 | [Indan-2-yl-(3-merc...) Show SMILES CC(CS)C(=O)N(CC(O)=O)C1Cc2ccccc2C1 Show InChI InChI=1S/C15H19NO3S/c1-10(9-20)15(19)16(8-14(17)18)13-6-11-4-2-3-5-12(11)7-13/h2-5,10,13,20H,6-9H2,1H3,(H,17,18)	MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibition of Angiotensin I converting enzyme				J Med Chem 26: 1267-77 (1983) BindingDB Entry DOI: 10.7270/Q29024B9
					More data for this Ligand-Target Pair