Acetic Acid — predicted protein targets

Known targets — ChEMBL curated mechanism

ADRA2A ADRA2B ADRA2C ADRB2 AGTR1 AVPR1A AVPR1B AVPR2 BDKRB2 CALCR CHRNA3 CHRNB4 ESR1 ESR2 GHSR GNRHR GSC1 HSPA8 MALT1 MC1R MC4R NOS1 NOS2 NOS3 OPRK1 OXTR RAMP1 RAMP2 RAMP3 SCN5A SSTR1 SSTR2 SSTR3 SSTR4 SSTR5 dacA dacB dacC folP ftsI mrcA mrcB mrdA rplA rplB rplC rplD rplE rplF rplJ rplK rplL rplM rplN rplO rplP rplQ rplR rplS rplT rplU rplV rplW rplX rplY rpmA rpmB rpmC rpmD rpmE rpmF rpmG rpmH rpmI rpmJ rpsA rpsB rpsC rpsD rpsE rpsF rpsG rpsH rpsI rpsJ rpsK rpsL rpsM rpsN rpsO rpsP rpsQ rpsR rpsS rpsT rpsU ykgM ykgO

The experimentally established mechanism targets of Acetic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	ST14	Q9Y5Y6	1/20	0.41

▸	F7	P08709	5/20	0.40

▸	F3	P13726	1/20	0.40

▸	F2	P00734	12/20	0.40

▸	MASP2	O00187	2/20	0.40

▸	ADRA1B	P35368	3/20	0.40

▸	F10	P00742	3/20	0.39

▸	PRSS1	P07477	2/20	0.39

▸	TMPRSS6	Q8IU80	3/20	0.36

▸	TPSAB1	Q15661	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
Acetic Acid SCHEMBL5041850	0.86	F10 (0.43)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5038059	0.85	F10 (0.46)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5038058	0.85	F10 (0.46)	ST14F7F3F2MASP2
Acetic Acid SCHEMBL5043149	0.84	F2 (0.43)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5041465	0.84	ST14 (0.44)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5041457	0.84	ST14 (0.44)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5045252	0.84	F7 (0.50)	F7F3F2MASP2ADRA1B
Hydrochloric Acid SCHEMBL5045248	0.84	F7 (0.50)	F7F3F2MASP2ADRA1B
Acetic Acid SCHEMBL5041870	0.83	F10 (0.44)	ST14F7F3F2MASP2
Hydrochloric Acid SCHEMBL5041846	0.83	F10 (0.46)	ST14F7F3F2MASP2

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

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-7129238-B2	Mandelic acid derivatives	HOFFMANN-LA ROCHE INC. (US)	2006-10-31	—	—	US	claimed
US-20040122057-A1	Novel mandelic acid derivatives	HOFFMANN-LA ROCHE INC.	2004-06-24	—	—	US	claimed
EP-1567498-B1	MANDELIC ACID DERIVATIVES	HOFFMANN LA ROCHE (CH)	2008-01-23	—	—	EP	disclosed
US-7129238-B2	Mandelic acid derivatives	HOFFMANN-LA ROCHE INC. (US)	2006-10-31	—	—	US	disclosed
EP-1567498-A2	MANDELIC ACID DERIVATIVES	F. HOFFMANN-LA ROCHE AG (CH)	2005-08-31	—	—	EP	disclosed
US-20040122057-A1	Novel mandelic acid derivatives	HOFFMANN-LA ROCHE INC.	2004-06-24	—	—	US	disclosed
WO-2004048335-A2	MANDELIC ACID DERIVATIVES	F. HOFFMANN-LA ROCHE AG (CH)	2004-06-10	—	—	WO	disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

Patent	Title	Text reads most about	Predicted target · text-rank
US-20040122057-A1	Novel mandelic acid derivatives	F7, F11, F9	ST14 1537/4885F7 1/4885F3 11/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.