Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Sorbic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.36 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 6/20 | 0.32 |
| ▸ | CNR1 | P21554 | 4/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Sorbic Acid SCHEMBL6744809 | 1.00 | CA1 (0.40) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL146360 | 0.95 | BBOX1 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL27789796 | 0.95 | BBOX1 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL146359 | 0.95 | BBOX1 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL1759655 | 0.92 | CA4 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL22284124 | 0.92 | CA4 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL562945 | 0.92 | BBOX1 (0.37) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL11578741 | 0.92 | BBOX1 (0.37) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL11578745 | 0.92 | BBOX1 (0.37) | CA1CA4BBOX1ALDH1A1CNR2 | |
| Sorbic Acid SCHEMBL11681562 | 0.90 | BBOX1 (0.36) | CA1CA4BBOX1ALDH1A1CNR2 |
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-6693216-B2 | A CALCIUM DOUBLE SALT OF ORGANIC (PRESERVATIVE) ACIDS OF FORMULA CA(R1)(R2) WHERE R1 AND R2 ARE DIFFERENT AND ARE EACH OOC-R3, R3=SATURATED OR MONOUNSATURATED OR POLYUNSATURATED C1-C5-ALKYL, C1-C5-HYDROXYALKYL OR PHENYL | NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) | 2004-02-17 | — | — | US | disclosed |
| US-20020068113-A1 | Calcium double salts | NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) | 2002-06-06 | — | — | US | disclosed |