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 | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.73 |
| ▸ | CA4 | P22748 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | THPO | P40225 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | FAHD1 | Q6P587 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
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 SCHEMBL28233704 | 0.96 | CA1 (0.67) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL4905553 | 0.95 | CA1 (0.80) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL11129525 | 0.95 | CA1 (0.80) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL11431290 | 0.95 | CA1 (0.80) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL1142957 | 0.95 | CA1 (0.80) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL9600657 | 0.91 | CA1 (0.73) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL11127360 | 0.91 | CA1 (0.73) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL28673158 | 0.91 | CA1 (0.73) | CA1CA4LMNAFFAR3TSHR | |
| Acetic Acid SCHEMBL30361177 | 0.91 | — | — | |
| Acetic Acid SCHEMBL28408878 | 0.91 | CA1 (0.73) | CA1CA4LMNAFFAR3TSHR |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118969990-A | Ternary positive electrode material, and preparation method and application thereof | 宁波容百新能源科技股份有限公司 | 2024-11-15 | — | — | CN | claimed |
| CN-106784792-A | Anode material for lithium-ion batteries and preparation method thereof | 深圳市沃特玛电池有限公司 | 2017-05-31 | — | — | CN | claimed |
| CN-118969990-A | Ternary positive electrode material, and preparation method and application thereof | 宁波容百新能源科技股份有限公司 | 2024-11-15 | — | — | CN | disclosed |
| CN-118666317-A | Doped nickel-cobalt-manganese ternary precursor and preparation method and application thereof | 荆门市格林美新材料有限公司 | 2024-09-20 | — | — | CN | disclosed |
| CN-107768628-B | Lithium ion battery anode material and preparation method thereof | 上海电力学院 | 2020-06-23 | — | — | CN | disclosed |
| CN-106784792-A | Anode material for lithium-ion batteries and preparation method thereof | 深圳市沃特玛电池有限公司 | 2017-05-31 | — | — | CN | disclosed |
| EP-2615671-A1 | LITHIUM SALT-GRAPHENE-CONTAINING COMPOSITE MATERIAL AND PREPARATION METHOD THEREOF | Ocean's King Lighting Science&Technology Co., Ltd. (CN) | 2013-07-17 | — | — | EP | disclosed |
| US-20130157135-A1 | LITHIUM SALT-GRAPHENE-CONTAINING COMPOSITE MATERIAL AND PREPARATION METHOD THEREOF | OCEAN'S KING LIGHTING SCIENCE & TECHNOLOGY CO., LTD. (CN) | 2013-06-20 | — | — | US | disclosed |