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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 SCHEMBL137819 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KDM4ETERTHSD11B1TSHR | |
| Acetic Acid SCHEMBL4187445 | 0.90 | CYP1A2 (0.48) | ALDH1A1KDM4ETERTHTTPOLB | |
| Bicarbonate SCHEMBL8660627 | 0.89 | ALDH1A1 (0.54) | ALDH1A1KDM4EHSD11B1TSHRHTT | |
| Acetic Acid SCHEMBL4192259 | 0.88 | CYP1A2 (0.52) | ALDH1A1KDM4ETERTHTTPOLB | |
| Methacrylic Acid SCHEMBL18107531 | 0.86 | ALDH1A1 (0.43) | ALDH1A1KDM4ETERTHSD11B1TSHR | |
| Bicarbonate SCHEMBL16669032 | 0.85 | PAOX (0.48) | ALDH1A1KDM4EHSD11B1TSHRHTT | |
| Propionic Acid SCHEMBL9326872 | 0.85 | FFAR3 (0.48) | ALDH1A1KDM4EHSD11B1TSHRHTT | |
| Acetic Acid SCHEMBL8411514 | 0.84 | KMT2A (0.42) | ALDH1A1KDM4ETERTPOLBKMT2A | |
| Acetic Acid SCHEMBL4194234 | 0.84 | ALDH1A1 (0.69) | ALDH1A1KDM4ETSHRKMT2APAOX | |
| Acetic Acid SCHEMBL19347190 | 0.84 | KMT2A (0.42) | ALDH1A1KDM4ETERTPOLBKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5371135-A | Hot melt adhesives, water soluble, alkali soluble, pigment dispersibility; modifiers with hydroxy, amino, mercapto and aziridnyl functional groups and a transition metal compound; grafted with acrylic or vinyl polymers and tackifier resin | TOYO INK MANUFACTURING CO., LTD. (JP) | 1994-12-06 | — | — | US | disclosed |
| US-5298568-A | Water soluble or dispersable | TOYO INK MANUFACTURING CO., LTD. (JP) | 1994-03-29 | — | — | US | disclosed |