BDBM41188 MLS000111800::SMR000107719::cid_2909321

SMILES: COc1ccc(cc1)-n1c2nncn2c2sc3CC(C)CCc3c2c1=O

InChI Key: InChIKey=NLDHPWWBNREELN-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 41188   

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
Procathepsin L (Homo sapiens (Human))	BDBM41188 (MLS000111800 | SMR000107719 | cid_2909321) Show SMILES COc1ccc(cc1)-n1c2nncn2c2sc3CC(C)CCc3c2c1=O Show InChI InChI=1S/C19H18N4O2S/c1-11-3-8-14-15(9-11)26-18-16(14)17(24)23(19-21-20-10-22(18)19)12-4-6-13(25-2)7-5-12/h4-7,10-11H,3,8-9H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q27D2SJC
					More data for this Ligand-Target Pair
ADP-ribosylation factor GTPase-activating protein 1 (Rattus norvegicus)	BDBM41188 (MLS000111800 | SMR000107719 | cid_2909321) Show SMILES COc1ccc(cc1)-n1c2nncn2c2sc3CC(C)CCc3c2c1=O Show InChI InChI=1S/C19H18N4O2S/c1-11-3-8-14-15(9-11)26-18-16(14)17(24)23(19-21-20-10-22(18)19)12-4-6-13(25-2)7-5-12/h4-7,10-11H,3,8-9H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.31E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2Q52N82
					More data for this Ligand-Target Pair
Procathepsin L (Homo sapiens (Human))	BDBM41188 (MLS000111800 | SMR000107719 | cid_2909321) Show SMILES COc1ccc(cc1)-n1c2nncn2c2sc3CC(C)CCc3c2c1=O Show InChI InChI=1S/C19H18N4O2S/c1-11-3-8-14-15(9-11)26-18-16(14)17(24)23(19-21-20-10-22(18)19)12-4-6-13(25-2)7-5-12/h4-7,10-11H,3,8-9H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2WH2NDV
					More data for this Ligand-Target Pair
Cathepsin S (Homo sapiens (Human))	BDBM41188 (MLS000111800 | SMR000107719 | cid_2909321) Show SMILES COc1ccc(cc1)-n1c2nncn2c2sc3CC(C)CCc3c2c1=O Show InChI InChI=1S/C19H18N4O2S/c1-11-3-8-14-15(9-11)26-18-16(14)17(24)23(19-21-20-10-22(18)19)12-4-6-13(25-2)7-5-12/h4-7,10-11H,3,8-9H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2V69H02
					More data for this Ligand-Target Pair