BDBM50335231 3-{5-[4-(2-Hydroxy-2-methyl-propionyl)-piperazin-1-yl]-2-trifluoromethyl-phenyl}-4-(1H-indol-3-yl)-pyrrole-2,5-dione::CHEMBL1650951::NIBR3049

SMILES: CC(C)(O)C(=O)N1CCN(CC1)c1ccc(c(c1)C1=C(C(=O)NC1=O)c1c[nH]c2ccccc12)C(F)(F)F

InChI Key: InChIKey=CLGRAWDGLMENOD-UHFFFAOYSA-N

Data: 23 IC50  2 EC50

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 25 hits for monomerid = 50335231   

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 JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	311	n/a	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)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Glycogen synthase kinase-3 beta (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Protein kinase C theta type (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	68	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Mouse)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.29E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	n/a	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)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.55E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	525	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.06E+3	n/a	n/a	n/a	n/a	7.5	30
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	1.04E+3	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	685	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	344	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1	n/a	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)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	578	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	n/a	n/a	n/a	n/a	7.5	30
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.55E+3	n/a	n/a	n/a	n/a	7.5	30
TBA									Citation and Details
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK1 (Human)	BDBM50335231 (NIBR3049 | CHEMBL1650951 | 3-{5-[4-(2-Hydroxy-2-me...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	7.5	30
TBA									Citation and Details
					More data for this Ligand-Target Pair