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 | |
|---|---|---|---|---|
| SCHEMBL617335 | 0.83 | — | — | |
| SCHEMBL77308 | 0.83 | — | — | |
| SCHEMBL466800 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL25230870 | 0.79 | — | — | |
| Acetic Acid SCHEMBL28843588 | 0.75 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL574619 | 0.75 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL174567 | 0.75 | — | — | |
| Acetic Acid SCHEMBL9659096 | 0.75 | FFAR3 (0.64) | — | |
| Acetic Acid SCHEMBL18528147 | 0.75 | — | — | |
| Acetic Acid SCHEMBL8772068 | 0.75 | FFAR3 (0.44) | — |
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-7314739-B2 | Lipase variants | BASF AKTIENGESELLSCHAFT (DE) | 2008-01-01 | — | — | US | disclosed |
| US-20050255571-A1 | Biocatalysts in chemical reactions, activity, stability and enantioselectivity; for the preparation of optically active compounds | BASF AKTIENGESELLSCHAFT (DE) | 2005-11-17 | — | — | US | disclosed |