BDBM50171038 CHEMBL3805213

SMILES: Cc1cc(C)c2cc(C3=CCCCC3)c(C)nc2c1

InChI Key: InChIKey=WKEPDBATSXCFTN-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 = 50171038   

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
20S proteasome chymotrypsin-like (Homo sapiens (Human))	BDBM50171038 (CHEMBL3805213) Show SMILES Cc1cc(C)c2cc(C3=CCCCC3)c(C)nc2c1 |t:8| Show InChI InChI=1S/C18H21N/c1-12-9-13(2)16-11-17(14(3)19-18(16)10-12)15-7-5-4-6-8-15/h7,9-11H,4-6,8H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a
Michigan State University Curated by ChEMBL					Assay Description Inhibition of human 20S proteasome chymotryptic-like activity using Suc-LLVY-AMC as substrate measured for 30 mins by fluorescence assay				Bioorg Med Chem 24: 2441-50 (2016) BindingDB Entry DOI: 10.7270/Q2PK0J26
					More data for this Ligand-Target Pair
Proteasome component C5 (Homo sapiens (Human))	BDBM50171038 (CHEMBL3805213) Show SMILES Cc1cc(C)c2cc(C3=CCCCC3)c(C)nc2c1 |t:8| Show InChI InChI=1S/C18H21N/c1-12-9-13(2)16-11-17(14(3)19-18(16)10-12)15-7-5-4-6-8-15/h7,9-11H,4-6,8H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
Michigan State University Curated by ChEMBL					Assay Description Inhibition of human 20S proteasome caspase beta1-like activity using Z-LLE-AMC as substrate measured for 30 mins by fluorescence assay				Bioorg Med Chem 24: 2441-50 (2016) BindingDB Entry DOI: 10.7270/Q2PK0J26
					More data for this Ligand-Target Pair
Proteasome Macropain subunit (Homo sapiens (Human))	BDBM50171038 (CHEMBL3805213) Show SMILES Cc1cc(C)c2cc(C3=CCCCC3)c(C)nc2c1 |t:8| Show InChI InChI=1S/C18H21N/c1-12-9-13(2)16-11-17(14(3)19-18(16)10-12)15-7-5-4-6-8-15/h7,9-11H,4-6,8H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Michigan State University Curated by ChEMBL					Assay Description Inhibition of human 20S proteasome tryptic beta2-like activity using Z-ARR-AMC as substrate measured for 30 mins by fluorescence assay				Bioorg Med Chem 24: 2441-50 (2016) BindingDB Entry DOI: 10.7270/Q2PK0J26
					More data for this Ligand-Target Pair