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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 4/20 | 0.33 |
| ▸ | CA2 | P00918 | 4/20 | 0.33 |
| ▸ | CA9 | Q16790 | 4/20 | 0.33 |
| ▸ | BCL2 | P10415 | 5/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 5/20 | 0.32 |
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 SCHEMBL1228847 | 0.95 | KDM4E (0.48) | KDM4ECA12CA2 | |
| Acetic Acid SCHEMBL1229633 | 0.90 | KDM4E (0.36) | KDM4ECA12CA2CA9 | |
| Acetic Acid SCHEMBL1229857 | 0.90 | KDM4E (0.48) | KDM4E | |
| Acetic Acid SCHEMBL1228939 | 0.86 | KDM4E (0.47) | KDM4ECA12CA2CA9BCL2 | |
| Acetic Acid SCHEMBL1229400 | 0.86 | KDM4E (0.47) | KDM4ECA12CA2CA9BCL2 | |
| Acetic Acid SCHEMBL1228879 | 0.85 | KDM4E (0.37) | KDM4ECA12 | |
| Acetic Acid SCHEMBL1229161 | 0.84 | KDM4E (0.47) | KDM4ECA12CA2CA9 | |
| Acetic Acid SCHEMBL1229611 | 0.83 | ACHE (0.36) | CA12CA2CA9 | |
| Acetic Acid SCHEMBL1228735 | 0.83 | MEN1 (0.36) | CA12CA2CA9 | |
| Acetic Acid SCHEMBL1227978 | 0.83 | KDM4E (0.44) | KDM4ECA12CA2CA9BCL2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110040070-A1 | ISOTACTIC POLY(ALKYLENE OXIDE) AND PRODUCTION PROCESS THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-02-17 | — | — | US | disclosed |