BDBM87048 Bisanilinopyrimidine inhibitor, 2::Bisanilinopyrimidine, 1::US9249124, 1

SMILES: c1ccc(c(c1)C(=O)O)Nc2ccnc(n2)Nc3ccc(cc3)C(=O)O

InChI Key: InChIKey=UIAQHDUGAOFVJM-UHFFFAOYSA-N

Data: 5 IC50  2 Kd  1 ITC

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 5 hits for monomerid = 87048   

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
Aurora kinase A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10	34	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aurora kinase A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aurora kinase A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10	n/a	n/a	n/a	n/a	7.4	25
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aurora kinase A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10	n/a	n/a	n/a	n/a	7.4	18
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aurora kinase A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.10	34	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 87048

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Serine/threonine-protein kinase Aurora-A (Human)	BDBM87048 (Bisanilinopyrimidine, 1 | Bisanilinopyrimidine inh...)	GoogleScholar			n/a	-3.35	-14.1	n/a	7.40	25
TBA					Details of this binding reaction