Literature summary for 2.7.10.2 extracted from

Bardelle, C.; Cross, D.; Davenport, S.; Kettle, J.G.; Ko, E.J.; Leach, A.G.; Mortlock, A.; Read, J.; Roberts, N.J.; Robins, P.; Williams, E.J.
Inhibitors of the tyrosine kinase EphB4. Part 1: Structure-based design and optimization of a series of 2,4-bis-anilinopyrimidines (2008), Bioorg. Med. Chem. Lett., 18, 2776-2780.

Application

Application	Comment	Organism
medicine	over-expression of Eph receptors on cancer cells is able to confer tumourigenic phenotypes such as proliferation and invasion, EphB4 could be a target for therapeutic intervention	Mammalia

Inhibitors

Inhibitors	Comment	Organism
2-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide	-	Mammalia
2-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile	-	Mammalia
3-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide	-	Mammalia
3-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile	-	Mammalia
4-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide	-	Mammalia
4-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile	-	Mammalia
N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine	-	Mammalia
N-(5-chloro-1,3-benzodioxol-4-yl)-N'-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine	-	Mammalia
N-(5-chloro-1,3-benzodioxol-4-yl)-N'-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-chlorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-fluorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-methoxyphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-methylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-chlorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-fluorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-methoxyphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-methylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-morpholin-4-ylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-chlorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-fluorophenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-methoxyphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-methylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-phenylpyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[2-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[3-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine	-	Mammalia
N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[4-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine	-	Mammalia

Natural Substrates/ Products (Substrates)

Natural Substrates	Organism	Comment (Nat. Sub.)	Natural Products	Comment (Nat. Pro.)	Rev.	Reac.
ATP + [protein]-L-tyrosine	Mammalia	-	ADP + [protein]-L-tyrosine phosphate	-	?

Organism

Organism	UniProt	Comment	Textmining
Mammalia	-	-	-

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
ATP + [protein]-L-tyrosine	-	Mammalia	ADP + [protein]-L-tyrosine phosphate	-	?

Synonyms

Synonyms	Comment	Organism
EphB4	-	Mammalia

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor
0.00004	-	-	Mammalia	3-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide
0.00009	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[3-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine
0.00024	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3,4,5-trimethoxyphenyl)pyrimidine-2,4-diamine
0.0003	-	-	Mammalia	4-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide
0.00035	-	-	Mammalia	N-(5-chloro-1,3-benzodioxol-4-yl)-6-methoxy-7-(3-piperidin-1-ylpropoxy)quinazolin-4-amine
0.00046	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-methylphenyl)pyrimidine-2,4-diamine
0.00055	-	-	Mammalia	3-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile
0.00058	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
0.00063	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[4-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine
0.00064	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-methoxyphenyl)pyrimidine-2,4-diamine
0.001	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
0.00115	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-fluorophenyl)pyrimidine-2,4-diamine
0.00125	-	-	Mammalia	4-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile
0.00133	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(3-chlorophenyl)pyrimidine-2,4-diamine
0.00155	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-phenylpyrimidine-2,4-diamine
0.0016	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-methylphenyl)pyrimidine-2,4-diamine
0.00194	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-methoxyphenyl)pyrimidine-2,4-diamine
0.0023	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-fluorophenyl)pyrimidine-2,4-diamine
0.00254	-	-	Mammalia	N-(5-chloro-1,3-benzodioxol-4-yl)-N'-(3,4,5-trimethoxyphenyl)pyrimidine-4,6-diamine
0.00296	-	-	Mammalia	N-(5-chloro-1,3-benzodioxol-4-yl)-N'-(3,4,5-trimethoxyphenyl)-1,3,5-triazine-2,4-diamine
0.00388	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-methoxyphenyl)pyrimidine-2,4-diamine
0.005	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-fluorophenyl)pyrimidine-2,4-diamine
0.006	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(4-chlorophenyl)pyrimidine-2,4-diamine
0.00785	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-morpholin-4-ylphenyl)pyrimidine-2,4-diamine
0.01132	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-chlorophenyl)pyrimidine-2,4-diamine
0.01396	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-(2-methylphenyl)pyrimidine-2,4-diamine
0.02049	-	-	Mammalia	2-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzonitrile
0.0355	-	-	Mammalia	2-([4-[(5-chloro-1,3-benzodioxol-4-yl)amino]pyrimidin-2-yl]amino)benzenesulfonamide
0.041	-	-	Mammalia	N4-(5-chloro-1,3-benzodioxol-4-yl)-N2-[2-(methylsulfonyl)phenyl]pyrimidine-2,4-diamine