SCHEMBL6918706 — predicted protein targets

Predicted protein targets (top 12)

	gene	UniProt	supporting neighbours	confidence
▸	GPBAR1	Q8TDU6	2/20	0.36

▸	DPP4	P27487	1/20	0.33

▸	FAP	Q12884	1/20	0.33

▸	MAOA	P21397	7/20	0.32

▸	MAOB	P27338	7/20	0.32

▸	F2	P00734	4/20	0.30

▸	F10	P00742	2/20	0.30

▸	F12	P00748	2/20	0.30

▸	PRSS1	P07477	2/20	0.30

▸	PRSS2	P07478	2/20	0.30

▸	F7	P08709	2/20	0.30

▸	PRSS3	P35030	2/20	0.30

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
SCHEMBL6914935	0.87	GPBAR1 (0.34)	GPBAR1
SCHEMBL6918709	0.80	F2 (0.41)	DPP4FAPF2F10F12
SCHEMBL6921239	0.78	F2 (0.38)	GPBAR1F2F10PRSS1PRSS2
SCHEMBL6922183	0.78	CYP3A4 (0.48)	GPBAR1F2F10PRSS1F7
SCHEMBL6816154	0.77	GPBAR1 (0.36)	GPBAR1DPP4MAOAMAOB
SCHEMBL6919609	0.73	CFD (0.40)	—
SCHEMBL6914941	0.72	VHL (0.38)	F2F10F12PRSS1PRSS2
SCHEMBL6919762	0.71	F2 (0.38)	GPBAR1F2F10PRSS1PRSS2
SCHEMBL6918997	0.69	CYP3A4 (0.45)	GPBAR1F2F10PRSS1F7
SCHEMBL6916861	0.69	CYP3A4 (0.45)	GPBAR1F2F10PRSS1F7

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-2004032834-A2	THROMBIN INHIBITORS	MERCK & CO., INC. (US)	2004-04-22	—	—	WO	claimed