Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
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 SCHEMBL6921925 | 1.00 | PKM (0.42) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL6681555 | 1.00 | PKM (0.42) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL5139547 | 0.84 | PKM (0.43) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL2506634 | 0.78 | PKM (0.38) | PKMKDM4EALDH1A1CYP4F2CYP4A11 | |
| Acetic Acid SCHEMBL3807902 | 0.78 | PKM (0.38) | PKMKDM4EALDH1A1CYP4F2CYP4A11 | |
| Acetic Acid SCHEMBL6224744 | 0.78 | PKM (0.38) | PKMKDM4EALDH1A1CYP4F2CYP4A11 | |
| Acetic Acid SCHEMBL719343 | 0.77 | PKM (0.46) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL6801309 | 0.77 | PKM (0.46) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL5427944 | 0.77 | PKM (0.46) | PKMKDM4EPIN1ALDH1A1RECQL | |
| Acetic Acid SCHEMBL720227 | 0.76 | PKM (0.41) | PKMKDM4EALDH1A1RECQLCYP4F2 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9000190-B2 | Amide compound or salt thereof, biofilm inhibitor, biofilm remover and disinfectant containing the same | UNIVERSITY OF TOKYO (JP) | 2015-04-07 | — | — | US | disclosed |
| EP-2077260-B1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF | UNIV TOKYO (JP) | 2015-02-18 | — | — | EP | disclosed |
| US-20150018564-A1 | AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | UNIVERSITY OF TOKYO (JP) | 2015-01-15 | — | — | US | disclosed |
| US-8748617-B2 | Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same | UNIVERSITY OF TOKYO (JP) | 2014-06-10 | — | — | US | disclosed |
| US-20120296094-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | OTSUKA CHEMICAL CO., LTD. (JP) | 2012-11-22 | — | — | US | disclosed |
| US-8258307-B2 | Amide compound or salt thereof, and biofilm inhibitor, biofilm remover and disinfectant containing the same | UNIVERSITY OF TOKYO (JP) | 2012-09-04 | — | — | US | disclosed |
| CN-101528686-A | Amide compound or salt thereof, and biofilm formation inhibitor, biofilm remover and bactericide each using the amide compound or salt thereof | UNIV TOKYO (JP) | 2009-09-09 | — | — | CN | disclosed |
| EP-2077260-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM FORMATION INHIBITOR, BIOFILM REMOVER AND BACTERICIDE EACH USING THE AMIDE COMPOUND OR SALT THEREOF | The University of Tokyo (JP) | 2009-07-08 | — | — | EP | disclosed |
| EP-2077109-A1 | AMIDE COMPOUND, SALT THEREOF, AND BIOFILM REMOVER USING THEM | The University of Tokyo (JP) | 2009-07-08 | — | — | EP | disclosed |
| US-20090068120-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | OTSUKA CHEMICAL CO., LTD. (JP) | 2009-03-12 | — | — | US | disclosed |
| US-20080241081-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME | UNIVERSITY OF TOKYO (JP) | 2008-10-02 | — | — | US | 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 (4 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-20150018564-A1 | AMIDE COMPOUND OR SALT THEREOF, BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | Q6ZSR9, F12, H1-0 | PKM 4691/4885KDM4E 306/4885PIN1 4568/4885 |
| US-20090068120-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | Q6ZSR9, F12, H1-0 | PKM 4512/4885KDM4E 349/4885PIN1 4480/4885 |
| US-20080241081-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM REMOVER CONTAINING THE SAME | H1-0, H1-10, H1-4 | PKM 4784/4885KDM4E 132/4885PIN1 2660/4885 |
| US-20120296094-A1 | AMIDE COMPOUND OR SALT THEREOF, AND BIOFILM INHIBITOR, BIOFILM REMOVER AND DISINFECTANT CONTAINING THE SAME | Q6ZSR9, F12, H1-0 | PKM 4512/4885KDM4E 349/4885PIN1 4480/4885 |
“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.