SCHEMBL28827997 — predicted protein targets

Predicted protein targets (top 15)

	gene	UniProt	supporting neighbours	confidence
▸	IDO1	P14902	5/20	0.44

▸	GSK3B	P49841	2/20	0.40

▸	TDO2	P48775	2/20	0.38

▸	BRPF1	P55201	1/20	0.38

▸	CREBBP	Q92793	1/20	0.38

▸	MAPT	P10636	6/20	0.38

▸	KDM4E	B2RXH2	4/20	0.38

▸	NPC1	O15118	2/20	0.38

▸	RAB9A	P51151	2/20	0.38

▸	TDP1	Q9NUW8	1/20	0.38

▸	L3MBTL1	Q9Y468	2/20	0.37

▸	GAA	P10253	1/20	0.37

▸	ALDH1A1	P00352	1/20	0.37

▸	HPGDS	O60760	1/20	0.36

▸	NLRP3	Q96P20	1/20	0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL28859743	0.78	IDO1 (0.46)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL24754644	0.78	IDO1 (0.46)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL29197967	0.78	IDO1 (0.50)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL8226202	0.74	MAPT (0.43)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL28414844	0.73	IDO1 (0.43)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL29951005	0.72	IDO1 (0.47)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL1101964	0.72	IDO1 (0.47)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL1491212	0.71	KDM4E (0.47)	IDO1GSK3BTDO2BRPF1CREBBP
SCHEMBL10615171	0.71	IDO1 (0.44)	IDO1GSK3BTDO2MAPTKDM4E
SCHEMBL19000599	0.70	IDO1 (0.51)	IDO1TDO2MAPTKDM4ENPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
CN-105566369-A	Isoindolinone formamide skeleton-containing boron bifluoride complex and preparing method thereof	UNIV BEIJING CHEMICAL TECH	2016-05-11	—	—	CN	disclosed