Trifluoroacetic Acid

SCHEMBL6161144

CC(C)(N)C(=O)N[C@H](COCc1ccccc1)C(=O)N1CCC(NC(=O)c2ccccc2)C1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 6)

	gene	UniProt	supporting neighbours	confidence
▸	GHSR	Q92847	8/20	0.51

▸	CYP3A4	P08684	3/20	0.48

▸	UGCG	Q16739	3/20	0.48

▸	CCKBR	P32239	3/20	0.46

▸	DRD2	P14416	1/20	0.42

▸	DRD4	P21917	1/20	0.42

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
Trifluoroacetic Acid SCHEMBL6165608	1.00	GHSR (0.51)	GHSRCYP3A4UGCGCCKBRDRD2
Trifluoroacetic Acid SCHEMBL6165597	1.00	GHSR (0.51)	GHSRCYP3A4UGCGCCKBRDRD2
SCHEMBL6162514	0.96	GHSR (0.54)	GHSRCYP3A4UGCGCCKBRDRD2
SCHEMBL6162518	0.96	GHSR (0.54)	GHSRCYP3A4UGCGCCKBRDRD2
SCHEMBL6162511	0.96	GHSR (0.54)	GHSRCYP3A4UGCGCCKBRDRD2
Trifluoroacetic Acid SCHEMBL6160642	0.89	GHSR (0.48)	GHSRCYP3A4UGCGCCKBR
Trifluoroacetic Acid SCHEMBL6160638	0.89	GHSR (0.48)	GHSRCYP3A4UGCGCCKBR
SCHEMBL6165333	0.84	GHSR (0.51)	GHSRCYP3A4UGCGCCKBR
SCHEMBL6163920	0.83	CYP3A4 (0.46)	GHSRCYP3A4UGCGCCKBR
SCHEMBL6163918	0.83	CYP3A4 (0.46)	GHSRCYP3A4UGCGCCKBR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-0828754-B1	DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE	PFIZER (US)	2005-02-02	—	—	EP	claimed
EP-0828754-B1	DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE	PFIZER (US)	2005-02-02	—	—	EP	disclosed