null

SMILES: CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O

InChI Key: InChIKey=NOVUHQXVIROLSK-RCCKNPSSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 67197   

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
Apelin receptor (Homo sapiens (Human))	BDBM67197 (1,1-dibutyl-3-[[(Z)-(3-methyl-5-oxidanylidene-1-ph...) Show SMILES CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O |w:12.11| Show InChI InChI=1S/C20H29N5OS/c1-4-6-13-24(14-7-5-2)20(27)22-21-15-18-16(3)23-25(19(18)26)17-11-9-8-10-12-17/h8-12,15,23H,4-7,13-14H2,1-3H3,(H,22,27)/b21-15+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	5.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanford-Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford- Sanford-Burnham Medical Research Institute(SBMRI, San...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2MK6BBZ
					More data for this Ligand-Target Pair
Hexokinase-1 (Homo sapiens (Human))	BDBM67197 (1,1-dibutyl-3-[[(Z)-(3-methyl-5-oxidanylidene-1-ph...) Show SMILES CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O |w:12.11| Show InChI InChI=1S/C20H29N5OS/c1-4-6-13-24(14-7-5-2)20(27)22-21-15-18-16(3)23-25(19(18)26)17-11-9-8-10-12-17/h8-12,15,23H,4-7,13-14H2,1-3H3,(H,22,27)/b21-15+	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	n/a	n/a	>8.00E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2765CSM
					More data for this Ligand-Target Pair
Hexokinase HKDC1 [W721R] (Homo sapiens (Human))	BDBM67197 (1,1-dibutyl-3-[[(Z)-(3-methyl-5-oxidanylidene-1-ph...) Show SMILES CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O |w:12.11| Show InChI InChI=1S/C20H29N5OS/c1-4-6-13-24(14-7-5-2)20(27)22-21-15-18-16(3)23-25(19(18)26)17-11-9-8-10-12-17/h8-12,15,23H,4-7,13-14H2,1-3H3,(H,22,27)/b21-15+	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	n/a	n/a	2.87E+4	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2R78CQV
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Homo sapiens (Human))	BDBM67197 (1,1-dibutyl-3-[[(Z)-(3-methyl-5-oxidanylidene-1-ph...) Show SMILES CCCCN(CCCC)C(=S)NN=Cc1c(C)[nH]n(-c2ccccc2)c1=O |w:12.11| Show InChI InChI=1S/C20H29N5OS/c1-4-6-13-24(14-7-5-2)20(27)22-21-15-18-16(3)23-25(19(18)26)17-11-9-8-10-12-17/h8-12,15,23H,4-7,13-14H2,1-3H3,(H,22,27)/b21-15+	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PCBioAssay	n/a	n/a	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute(SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2CJ8BXT
					More data for this Ligand-Target Pair