BDBM268058 4-(2-fluoro-4-methylpyridin-3-yl)-2-[(3R)-3-methylmorpholin-4-yl]-8-(1H-pyrazol-5-yl)-1,7-naphthyridine::US10772893, Example 90::US9549932, 90

SMILES: C[C@@H]1COCCN1c1cc(-c2c(C)ccnc2F)c2ccnc(-c3ccn[nH]3)c2n1

InChI Key:

Data: 2 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 2 hits for monomerid = 268058   

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
ATR/ATRIP (Homo sapiens (Human))	BDBM268058 (4-(2-fluoro-4-methylpyridin-3-yl)-2-[(3R)-3-methyl...) Show SMILES C[C@@H]1COCCN1c1cc(-c2c(C)ccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.21,;-2,3.44,;-3.33,4.21,;-4.67,3.44,;-4.67,1.9,;-3.33,1.13,;-2,1.9,;-.67,1.13,;-.67,-.41,;.67,-1.18,;.67,-2.72,;-.67,-3.49,;-2,-2.72,;-.67,-5.03,;.67,-5.8,;2,-5.03,;2,-3.49,;3.33,-2.72,;2,-.41,;3.33,-1.18,;4.67,-.41,;4.67,1.13,;3.33,1.9,;3.33,3.44,;2.09,4.34,;2.56,5.8,;4.1,5.8,;4.58,4.34,;2,1.13,;.67,1.9,)| Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10.6	n/a	n/a	n/a	n/a	n/a	n/a
BAYER PHARMA AKTIENGESELLSCHAFT US Patent					Assay Description To determine of binding activity of the test compounds, full-length human ATR protein was expressed and purified together with ATRIP as described abo...				US Patent US10772893 (2020)
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase ATR (Homo sapiens (Human))	BDBM268058 (4-(2-fluoro-4-methylpyridin-3-yl)-2-[(3R)-3-methyl...) Show SMILES C[C@@H]1COCCN1c1cc(-c2c(C)ccnc2F)c2ccnc(-c3ccn[nH]3)c2n1 |r,wU:1.0,(-.67,4.21,;-2,3.44,;-3.33,4.21,;-4.67,3.44,;-4.67,1.9,;-3.33,1.13,;-2,1.9,;-.67,1.13,;-.67,-.41,;.67,-1.18,;.67,-2.72,;-.67,-3.49,;-2,-2.72,;-.67,-5.03,;.67,-5.8,;2,-5.03,;2,-3.49,;3.33,-2.72,;2,-.41,;3.33,-1.18,;4.67,-.41,;4.67,1.13,;3.33,1.9,;3.33,3.44,;2.09,4.34,;2.56,5.8,;4.1,5.8,;4.58,4.34,;2,1.13,;.67,1.9,)| Show InChI	PDB Reactome pathway UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10.6	n/a	n/a	n/a	n/a	7.0	n/a
Bayer Pharma Aktiengesellschaft US Patent					Assay Description To determine of binding activity of the test compounds, full-length human ATR protein was expressed and purified together with ATRIP as described abo...				US Patent US9549932 (2017) BindingDB Entry DOI: 10.7270/Q27S7QSC
					More data for this Ligand-Target Pair