BDBM362416 4-{7-amino-3- [(3R,6S)-1- (cyclopropylcarbonyl)- 6-methylpiperidin- 3-yl]-1H-pyrazolo[3,4-c] pyridin-1-yl}-N-(4- cyclopropylpyridin-2- yl)benzamide::US9834554, Example 31
SMILES: C[C@H]1CC[C@H](CN1C(=O)C1CC1)c1nn(-c2ccc(cc2)C(=O)Nc2cc(ccn2)C2CC2)c2c(N)nccc12
InChI Key: InChIKey=FGZQTGTUHCCFCO-FDDCHVKYSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosine-protein kinase BTK (Homo sapiens (Human)) | BDBM362416 (4-{7-amino-3- [(3R,6S)-1- (cyclopropylcarbonyl)- 6...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | UniChem | US Patent | n/a | n/a | 1.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Sharp & Dohme Corp. US Patent | Assay Description BTK enzymatic activity was determined with the LANCE (Lanthanide Chelate Excite) TR-FRET (Time-resolved fluorescence resonance energy transfer) assay... | US Patent US9834554 (2017) BindingDB Entry DOI: 10.7270/Q2K64MCV | |||||||||||
More data for this Ligand-Target Pair |