SCHEMBL7754261 — predicted protein targets

Predicted protein targets (top 9)

	gene	UniProt	supporting neighbours	confidence
▸	CYP1A2	P05177	3/20	0.43

▸	CYP2C9	P11712	3/20	0.43

▸	CYP2C19	P33261	3/20	0.43

▸	CYP3A4	P08684	2/20	0.43

▸	GAA	P10253	1/20	0.43

▸	NPSR1	Q6W5P4	2/20	0.43

▸	ATM	Q13315	1/20	0.41

▸	ALDH1A1	P00352	1/20	0.40

▸	SMN1; SMN2	Q16637	1/20	0.40

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
SCHEMBL7754266	1.00	CYP1A2 (0.43)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7755664	0.91	CYP1A2 (0.42)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7755665	0.91	CYP1A2 (0.42)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7755689	0.91	CYP1A2 (0.44)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7755677	0.91	CYP1A2 (0.44)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7753618	0.84	CYP1A2 (0.43)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7753627	0.84	CYP1A2 (0.43)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7749537	0.82	CYP1A2 (0.42)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7749532	0.82	CYP1A2 (0.42)	CYP1A2CYP2C9CYP2C19CYP3A4GAA
SCHEMBL7754495	0.80	CYP1A2 (0.47)	CYP1A2CYP2C9CYP2C19CYP3A4GAA

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
WO-2001047863-A2	NEW HERBICIDAL COMPOSITIONS	AVENTIS CROPSCIENCE SA (FR)	2001-07-05	—	—	WO	disclosed