BDBM50009091 CHEMBL3237990

SMILES: CC#C[C@H]1CN(CCN1c1ccc(cc1)S(C)=O)S(=O)(=O)c1ccc(N)nc1

InChI Key: InChIKey=UPRPVIHHGCLFKU-CJKOFORZSA-N

Data: 1 IC50  1 EC50

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 = 50009091   

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
Glucokinase regulatory protein (Mus musculus)	BDBM50009091 (CHEMBL3237990) Show SMILES CC#C[C@H]1CN(CCN1c1ccc(cc1)S(C)=O)S(=O)(=O)c1ccc(N)nc1 |r| Show InChI InChI=1S/C19H22N4O3S2/c1-3-4-16-14-22(28(25,26)18-9-10-19(20)21-13-18)11-12-23(16)15-5-7-17(8-6-15)27(2)24/h5-10,13,16H,11-12,14H2,1-2H3,(H2,20,21)/t16-,27?/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	>1.25E+4	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of GKRP-GK interaction in mouse hepatocytes assessed as induction of GK translocation from nucleus to cytoplasm incubated for 20 mins prio...				J Med Chem 57: 3094-116 (2014) Article DOI: 10.1021/jm5000497 BindingDB Entry DOI: 10.7270/Q2V126BF
					More data for this Ligand-Target Pair
Glucokinase regulatory protein (Homo sapiens (Human))	BDBM50009091 (CHEMBL3237990) Show SMILES CC#C[C@H]1CN(CCN1c1ccc(cc1)S(C)=O)S(=O)(=O)c1ccc(N)nc1 |r| Show InChI InChI=1S/C19H22N4O3S2/c1-3-4-16-14-22(28(25,26)18-9-10-19(20)21-13-18)11-12-23(16)15-5-7-17(8-6-15)27(2)24/h5-10,13,16H,11-12,14H2,1-2H3,(H2,20,21)/t16-,27?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of biotin-tagged human GKRP/fluorescein-tagged GK interaction preincubated for 20 mins prior to GK addition measured after 2 to 4 hrs by A...				J Med Chem 57: 3094-116 (2014) Article DOI: 10.1021/jm5000497 BindingDB Entry DOI: 10.7270/Q2V126BF
					More data for this Ligand-Target Pair