BDBM50540184 CHEMBL4643627
SMILES: CC(=O)N1CCC(CC1)c1nsc(Nc2ncc(Sc3ccccn3)cc2Oc2cccc3ncccc23)n1
InChI Key: InChIKey=JNDNJMYZHYPZGD-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50540184 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/Glucokinase regulatory protein
(Homo sapiens (Human)) | BDBM50540184
(CHEMBL4643627)Show SMILES CC(=O)N1CCC(CC1)c1nsc(Nc2ncc(Sc3ccccn3)cc2Oc2cccc3ncccc23)n1 Show InChI InChI=1S/C28H25N7O2S2/c1-18(36)35-14-10-19(11-15-35)26-32-28(39-34-26)33-27-24(16-20(17-31-27)38-25-9-2-3-12-30-25)37-23-8-4-7-22-21(23)6-5-13-29-22/h2-9,12-13,16-17,19H,10-11,14-15H2,1H3,(H,31,32,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| PubMed
| n/a | n/a | n/a | n/a | 504 | n/a | n/a | n/a | n/a |
Array BioPharma Inc.
Curated by ChEMBL
| Assay Description Activation of glucokinase (unknown origin) in presence of 4% human serum albumin |
Bioorg Med Chem 28: (2020)
|
More data for this Ligand-Target Pair | |
Glucokinase/Glucokinase regulatory protein
(Homo sapiens (Human)) | BDBM50540184
(CHEMBL4643627)Show SMILES CC(=O)N1CCC(CC1)c1nsc(Nc2ncc(Sc3ccccn3)cc2Oc2cccc3ncccc23)n1 Show InChI InChI=1S/C28H25N7O2S2/c1-18(36)35-14-10-19(11-15-35)26-32-28(39-34-26)33-27-24(16-20(17-31-27)38-25-9-2-3-12-30-25)37-23-8-4-7-22-21(23)6-5-13-29-22/h2-9,12-13,16-17,19H,10-11,14-15H2,1H3,(H,31,32,33,34) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| PubMed
| n/a | n/a | n/a | n/a | 9.30 | n/a | n/a | n/a | n/a |
Array BioPharma Inc.
Curated by ChEMBL
| Assay Description Activation of glucokinase (unknown origin) |
Bioorg Med Chem 28: (2020)
|
More data for this Ligand-Target Pair | |