BDBM36485 1-(4-(4-(2-(Isopropylsulfonyl)phenylamino)-1H-pyrrolo[2,3-b]pyridin-6-ylamino)-3-methoxyphenyl)piperidin-4-ol::Mps1-IN-1::US11208696, Example 30

SMILES: COc1cc(ccc1Nc1cc(Nc2ccccc2S(=O)(=O)C(C)C)c2cc[nH]c2n1)N1CCC(O)CC1

InChI Key: InChIKey=NMJMRSQTDLRCRQ-UHFFFAOYSA-N

Data: 3 IC50

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 3 hits for monomerid = 36485   

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
Dual specificity protein kinase TTK (Human)	BDBM36485 (1-(4-(4-(2-(Isopropylsulfonyl)phenylamino)-1H-pyrr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	367	n/a	n/a	n/a	n/a	7.5	0
TBA									Citation and Details
					More data for this Ligand-Target Pair
Dual specificity protein kinase TTK (Human)	BDBM36485 (1-(4-(4-(2-(Isopropylsulfonyl)phenylamino)-1H-pyrr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	37.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Dual specificity protein kinase TTK (Human)	BDBM36485 (1-(4-(4-(2-(Isopropylsulfonyl)phenylamino)-1H-pyrr...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair