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.
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 SCHEMBL27972756 | 1.00 | — | — | |
| Acetic Acid SCHEMBL7197355 | 1.00 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL29281427 | 1.00 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL3252180 | 0.86 | — | — | |
| Bicarbonate SCHEMBL3917413 | 0.86 | — | — | |
| Bicarbonate SCHEMBL16673755 | 0.86 | CA1 (0.50) | — | |
| Bicarbonate SCHEMBL29012214 | 0.86 | — | — | |
| Acetone SCHEMBL10806071 | 0.86 | — | — | |
| Bicarbonate SCHEMBL194552 | 0.86 | — | — | |
| Bicarbonate SCHEMBL27775306 | 0.86 | CA1 (0.50) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104114594-B | Preparation, purification and use of high-X diblock copolymers | 纳幕尔杜邦公司 | 2017-05-24 | — | — | CN | disclosed |
| CN-104800876-A | Deodorant suitable for organic solid waste suitable for heat treatment and application of deodorant | BEIJING BUILDING MATERIALS ACADEMY SCIENCES RES | 2015-07-29 | — | — | CN | disclosed |
| CN-104114594-A | Preparation, purification and use of high-X diblock copolymers | DU PONT | 2014-10-22 | — | — | CN | disclosed |
| CN-1273579-A | Anthranilic acid analogs | AMERICAN HOME PROD (US) | 2000-11-15 | — | — | CN | disclosed |