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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL819291 | 0.93 | TSHR (0.60) | TSHRTP53ALDH1A1CA1CA2 | |
| SCHEMBL27302801 | 0.89 | TSHR (0.55) | TSHRTP53ALDH1A1CA1CA2 | |
| Ethylene Glycol SCHEMBL17819037 | 0.85 | TSHR (0.50) | TSHRTP53ALDH1A1CA1CA2 | |
| Benzoic Acid SCHEMBL28063446 | 0.84 | TSHR (0.64) | TSHRTP53ALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL3171176 | 0.83 | CA1 (0.44) | TSHRTP53ALDH1A1CA1CA2 | |
| SCHEMBL27302798 | 0.81 | LMNA (0.44) | TSHRTP53ALDH1A1CA1CA2 | |
| Terephthalic Acid SCHEMBL123278 | 0.81 | TSHR (0.80) | TSHRTP53ALDH1A1CA1CA2 | |
| Terephthalic Acid SCHEMBL8209798 | 0.81 | TSHR (0.80) | TSHRTP53ALDH1A1CA1CA2 | |
| Terephthalic Acid SCHEMBL28358071 | 0.81 | TSHR (0.80) | TSHRTP53ALDH1A1CA1CA2 | |
| SCHEMBL4294882 | 0.78 | TSHR (0.56) | TSHRTP53ALDH1A1SMN1; SMN2HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20180155531-A1 | HALOGEN-FREE PLASTIC FLOOR TILE AND MODIFIED POLYESTER COMPOSITION FOR USE IN PRODUCING THE SAME | NAN YA PLASTICS CORPORATION (TW) | 2018-06-07 | — | — | US | disclosed |
| US-9951206-B2 | Halogen-free plastic floor tile and modified polyester composition for use in producing the same | NAN YA PLASTICS CORPORATION (TW) | 2018-04-24 | — | — | US | disclosed |
| US-20160168358-A1 | HALOGEN-FREE PLASTIC FLOOR TILE AND MODIFIED POLYESTER COMPOSITION FOR USE IN PRODUCING THE SAME | NAN YA PLASTICS CORPORATION (TW) | 2016-06-16 | — | — | US | disclosed |