BDBM12987 5-Amido-pyrrolopyrazole 9f::CHEMBL384575::N-{5-[(2S)-2-methoxy-2-phenylacetyl]-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-3-yl}-4-(4-methylpiperazin-1-yl)benzamide

SMILES: CO[C@H](C(=O)N1Cc2n[nH]c(NC(=O)c3ccc(cc3)N3CCN(C)CC3)c2C1)c1ccccc1

InChI Key: InChIKey=XKFTZKGMDDZMJI-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 12987   

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)	BDBM12987 (CHEMBL384575 | N-{5-[(2S)-2-methoxy-2-phenylacetyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	354	n/a	n/a	n/a	n/a	7.5	22
TBA									Citation and Details
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Aurora kinase B (Human)	BDBM12987 (CHEMBL384575 | N-{5-[(2S)-2-methoxy-2-phenylacetyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	630	n/a	n/a	n/a	n/a	7.5	22
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aurora kinase B (Human)	BDBM12987 (CHEMBL384575 | N-{5-[(2S)-2-methoxy-2-phenylacetyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Aurora kinase A (Human)	BDBM12987 (CHEMBL384575 | N-{5-[(2S)-2-methoxy-2-phenylacetyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	354	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Breakpoint cluster region protein/Tyrosine-protein kinase ABL1 (Human)	BDBM12987 (CHEMBL384575 | N-{5-[(2S)-2-methoxy-2-phenylacetyl...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair