BDBM317466 4-(4-methoxy-5-(pyridin-4-yl)- 7H-pyrrolo[2,3-d]pyrimidin-2- ylamino)-N,N,3- trimethylbenzamide::US9623028, Compound 89

SMILES: COc1nc(Nc2ccc(cc2C)C(=O)N(C)C)nc2[nH]cc(-c3ccncc3)c12

InChI Key: InChIKey=NJLSVJABWRFGRL-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 = 317466   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM317466 (4-(4-methoxy-5-(pyridin-4-yl)- 7H-pyrrolo[2,3-d]py...) Show SMILES COc1nc(Nc2ccc(cc2C)C(=O)N(C)C)nc2[nH]cc(-c3ccncc3)c12 Show InChI InChI=1S/C22H22N6O2/c1-13-11-15(21(29)28(2)3)5-6-17(13)25-22-26-19-18(20(27-22)30-4)16(12-24-19)14-7-9-23-10-8-14/h5-12H,1-4H3,(H2,24,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.5	n/a	n/a	n/a	n/a	n/a	n/a
Signal Pharmaceuticals, LLC US Patent					Assay Description The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...				US Patent US9623028 (2017) BindingDB Entry DOI: 10.7270/Q2VQ34R8
					More data for this Ligand-Target Pair
Dual specificity protein kinase CLK2 (Homo sapiens (Human))	BDBM317466 (4-(4-methoxy-5-(pyridin-4-yl)- 7H-pyrrolo[2,3-d]py...) Show SMILES COc1nc(Nc2ccc(cc2C)C(=O)N(C)C)nc2[nH]cc(-c3ccncc3)c12 Show InChI InChI=1S/C22H22N6O2/c1-13-11-15(21(29)28(2)3)5-6-17(13)25-22-26-19-18(20(27-22)30-4)16(12-24-19)14-7-9-23-10-8-14/h5-12H,1-4H3,(H2,24,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.56	n/a	n/a	n/a	n/a	n/a	n/a
Signal Pharmaceuticals, LLC US Patent					Assay Description The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...				US Patent US9623028 (2017) BindingDB Entry DOI: 10.7270/Q2VQ34R8
					More data for this Ligand-Target Pair
Dual specificty protein kinase CLK1 (Homo sapiens (Human))	BDBM317466 (4-(4-methoxy-5-(pyridin-4-yl)- 7H-pyrrolo[2,3-d]py...) Show SMILES COc1nc(Nc2ccc(cc2C)C(=O)N(C)C)nc2[nH]cc(-c3ccncc3)c12 Show InChI InChI=1S/C22H22N6O2/c1-13-11-15(21(29)28(2)3)5-6-17(13)25-22-26-19-18(20(27-22)30-4)16(12-24-19)14-7-9-23-10-8-14/h5-12H,1-4H3,(H2,24,25,26,27)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	41.5	n/a	n/a	n/a	n/a	n/a	n/a
Signal Pharmaceuticals, LLC US Patent					Assay Description The kinase activity is measured using a radioactivity based kinase assay, which measures the incorporation of a radioactively labeled phosphate moiet...				US Patent US9623028 (2017) BindingDB Entry DOI: 10.7270/Q2VQ34R8
					More data for this Ligand-Target Pair