BDBM93603 MLS003355872::N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-quinolinyl)acetamide::N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(4-quinolyl)acetamide::N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinolin-4-yl-ethanamide::N-cyclohexyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-quinolin-4-ylacetamide::SMR002044437::cid_51361425

SMILES: O=C(NC1CCCCC1)C(N1CCc2ccccc2C1)c1ccnc2ccccc12

InChI Key: InChIKey=BHEBFNOMPOLHMJ-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 = 93603   

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
Caspase-3 (Homo sapiens (Human))	BDBM93603 (MLS003355872 | N-cyclohexyl-2-(3,4-dihydro-1H-isoq...) Show SMILES O=C(NC1CCCCC1)C(N1CCc2ccccc2C1)c1ccnc2ccccc12 Show InChI InChI=1S/C26H29N3O/c30-26(28-21-10-2-1-3-11-21)25(23-14-16-27-24-13-7-6-12-22(23)24)29-17-15-19-8-4-5-9-20(19)18-29/h4-9,12-14,16,21,25H,1-3,10-11,15,17-18H2,(H,28,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	9.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2930RSV
					More data for this Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8 (Homo sapiens (Human))	BDBM93603 (MLS003355872 | N-cyclohexyl-2-(3,4-dihydro-1H-isoq...) Show SMILES O=C(NC1CCCCC1)C(N1CCc2ccccc2C1)c1ccnc2ccccc12 Show InChI InChI=1S/C26H29N3O/c30-26(28-21-10-2-1-3-11-21)25(23-14-16-27-24-13-7-6-12-22(23)24)29-17-15-19-8-4-5-9-20(19)18-29/h4-9,12-14,16,21,25H,1-3,10-11,15,17-18H2,(H,28,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2JM2870
					More data for this Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8 (Homo sapiens (Human))	BDBM93603 (MLS003355872 | N-cyclohexyl-2-(3,4-dihydro-1H-isoq...) Show SMILES O=C(NC1CCCCC1)C(N1CCc2ccccc2C1)c1ccnc2ccccc12 Show InChI InChI=1S/C26H29N3O/c30-26(28-21-10-2-1-3-11-21)25(23-14-16-27-24-13-7-6-12-22(23)24)29-17-15-19-8-4-5-9-20(19)18-29/h4-9,12-14,16,21,25H,1-3,10-11,15,17-18H2,(H,28,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2P849HJ
					More data for this Ligand-Target Pair