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 | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.38 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.38 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | FAP | Q12884 | 1/20 | 0.38 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.38 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.38 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
| ▸ | LAP3 | P28838 | 1/20 | 0.32 |
| ▸ | ANPEP | P15144 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL204828 | 0.93 | — | — | |
| SCHEMBL135982 | 0.93 | — | — | |
| SCHEMBL135981 | 0.93 | — | — | |
| SCHEMBL2239379 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Bromide SCHEMBL28463120 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Hydrochloric Acid SCHEMBL261172 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Ammonia Solution, Strong SCHEMBL27488505 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Bromide SCHEMBL28463121 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Hydrochloric Acid SCHEMBL345942 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 | |
| Hydrochloric Acid SCHEMBL203200 | 0.90 | SMN1; SMN2 (0.48) | SLC7A5SMN1; SMN2CA14CA12SLC1A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103743784-B | Based on the enantiomorph potentiometric sensor of four (4-tert-butyl-phenyl) potassium borate and the application in valine methyl ester detects thereof | YUNNAN NORMAL UNIVERSITY (CN) | 2016-01-20 | — | — | CN | disclosed |
| CN-103743795-B | Based on the enantiomorph potentiometric sensor of sodium tetraphenylborate and the application in valine methyl ester detects thereof | YUNNAN NORMAL UNIVERSITY (CN) | 2015-09-30 | — | — | CN | disclosed |