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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 2/20 | 0.41 |
| ▸ | ESR2 known ✓ | Q92731 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8995866 | 0.93 | MAPT (0.58) | MAPTKMT2ACYP1A2CYP2D6CYP2C19 | |
| SCHEMBL6145 | 0.87 | KCNN4 (0.58) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Acetic Acid SCHEMBL9574973 | 0.86 | MAPT (0.56) | MAPTKMT2ACYP1A2CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL8387827 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Methylamine SCHEMBL20916863 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Fluoride SCHEMBL634655 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Bromide SCHEMBL414533 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Water SCHEMBL4609376 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Iodide SCHEMBL6672017 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 | |
| Bromide SCHEMBL3629993 | 0.85 | KCNN4 (0.55) | MAPTKMT2AKCNN4AKT1AKT2 |
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 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7745516-B2 | Composition of polyimide and sterically-hindered hydrophobic epoxy | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-06-29 | — | — | US | claimed |
| EP-1943311-A1 | COMPOSITIONS COMPRISING POLYIMIDE AND HYDROPHOBIC EPOXY, AND METHODS RELATING THERETO | E.I.Du pont de nemours and company (US) | 2008-07-16 | — | — | EP | claimed |
| US-20070244267-A1 | Hydrophobic crosslinkable compositions for electronic applications | E. I. DU PONT DE NEMOURS AND COMPANY | 2007-10-18 | — | — | US | claimed |
| EP-1845130-A2 | Hydrophobic crosslinkable compositions for electronic applications | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2007-10-17 | — | — | EP | claimed |
| WO-2007047384-A1 | COMPOSITIONS COMPRISING POLYIMIDE AND HYDROPHOBIC EPOXY, AND METHODS RELATING THERETO | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2007-04-26 | — | — | WO | claimed |
| US-20070083017-A1 | Compositions comprising polyimide and hydrophobic epoxy, and methods relating thereto | CDA PROCESSING LIMITED LIABILITY COMPANY | 2007-04-12 | — | — | US | claimed |
| EP-0319814-B1 | METHOD OF PREPARING ASYMMETRICAL DIHYDROPYRIDINES | BAYER AG (DE) | 1992-09-16 | — | — | EP | claimed |
| US-4904789-A | Process for the preparation of unsymmetrical dihydropyridines | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | claimed |
| JP-1197470-A | — | — | None | — | — | JP | disclosed |
| EP-2092807-B1 | COMPOSITE ORGANIC ENCAPSULANTS | CDA PROC LTD LIABILITY COMPANY (US) | 2013-04-17 | — | — | EP | disclosed |
| US-8233261-B2 | Composite organic encapsulants | CDA PROCESSING LIMITED LIABILITY COMPANY (US) | 2012-07-31 | — | — | US | disclosed |
| US-7745516-B2 | Composition of polyimide and sterically-hindered hydrophobic epoxy | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2010-06-29 | — | — | US | disclosed |
| US-20100067168-A1 | COMPOSITE ORGANIC ENCAPSULANTS | E.I. DU PONT DE NEMOURS AND COMPANY Patents Records Center/Dupont Legal (DE) | 2010-03-18 | — | — | US | disclosed |
| US-7604754-B2 | Resistor compositions for electronic circuitry applications | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2009-10-20 | — | — | US | disclosed |
| US-4916019-A | EPOXY RESIN, NONIONIC RESIN AND BLOCKED ISOCYANATE CURING AGENT; WEATHERPROOF, ANTICORROSIVE | KANSAI PAINT CO., LTD. (JP) | 1990-04-10 | — | — | US | disclosed |
| US-4904361-A | Electrodeposition coating composition | KANSAI PAINT CO., LTD. (JP) | 1990-02-27 | — | — | US | disclosed |
| US-4904789-A | Process for the preparation of unsymmetrical dihydropyridines | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | disclosed |
| US-4904789-A | Process for the preparation of unsymmetrical dihydropyridines | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-27 | — | — | US | disclosed |
| JP-H01197470-A | PREPARATION OF UNSYMMETRICAL DIHYDROPYRIDINES | BAYER AG | 1989-08-09 | — | — | JP | disclosed |
| EP-0319814-A2 | Method of preparing asymmetrical dihydropyridines | BAYER AG (DE) | 1989-06-14 | — | — | EP | disclosed |