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 | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | AKR1B10 | O60218 | 4/20 | 0.55 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL146669 | 0.95 | THRB (0.63) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| Methacrylic Acid SCHEMBL27992784 | 0.93 | THRB (0.54) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| SCHEMBL27929355 | 0.92 | THRB (0.59) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| Propionic Acid SCHEMBL28013213 | 0.91 | THRB (0.55) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| Acrylic Acid Methyl Ester SCHEMBL27986778 | 0.91 | THRB (0.55) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| Formic Acid SCHEMBL28238298 | 0.91 | THRB (0.58) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| SCHEMBL147883 | 0.90 | THRB (0.61) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| SCHEMBL28209318 | 0.90 | THRB (0.54) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| SCHEMBL28013204 | 0.90 | THRB (0.54) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 | |
| SCHEMBL28021234 | 0.89 | THRB (0.56) | THRBLMNAAKR1B10AKR1B1SMN1; SMN2 |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105051964-A | Nonaqueous electrolyte secondary battery | SANYO ELECTRIC CO | 2015-11-11 | — | — | CN | claimed |
| CN-106415910-B | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2019-05-03 | — | — | CN | disclosed |
| CN-105580189-B | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | 三菱化学株式会社 | 2017-09-22 | — | — | CN | disclosed |
| CN-107078352-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2017-08-18 | — | — | CN | disclosed |
| CN-104205472-B | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | 三菱化学株式会社 | 2017-04-12 | — | — | CN | disclosed |
| CN-106415910-A | Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same | 三菱化学株式会社 | 2017-02-15 | — | — | CN | disclosed |
| CN-105580189-A | Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same | MITSUBISHI CHEM CORP | 2016-05-11 | — | — | CN | disclosed |
| CN-105051964-A | Nonaqueous electrolyte secondary battery | SANYO ELECTRIC CO | 2015-11-11 | — | — | CN | disclosed |
| CN-104937149-A | Polyurethane fiber | TORAY OPELONTEX CO LTD | 2015-09-23 | — | — | CN | disclosed |
| CN-101669887-B | Hair processing agent and method for permanent waving hair | SHOWA DENKO KK | 2012-12-05 | — | — | CN | disclosed |
| CN-101083975-B | Hair treatment agent and hair waving method | SHOWA DENKO KK | 2010-12-01 | — | — | CN | disclosed |
| CN-101669887-A | Hair processing agent and method for permanent waving hair | SHOWA DENKO KK | 2010-03-17 | — | — | CN | disclosed |
| CN-101083975-A | Hair treatment agent and hair waving method | SHOWA DENKO KK (JP) | 2007-12-05 | — | — | CN | disclosed |