BDBM50514908 CHEMBL4539227::US12110278, Compound 9

SMILES: c1cc(ccc1C#N)Nc2nc(n(n2)C(=O)Nc3ccc(cc3)OCC(=O)O)N

InChI Key: InChIKey=TWAPQXNNCFSTFQ-UHFFFAOYSA-N

Data: 2 Kd

PDB links: 1 PDB ID matches this monomer.

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 = 50514908   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Tyrosine-protein kinase JAK2 [536-812,W659A,W777A,F794H] (Human)	BDBM50514908 (CHEMBL4539227 | US12110278, Compound 9) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	643	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Human)	BDBM50514908 (CHEMBL4539227 | US12110278, Compound 9) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	643	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair