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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 6/20 | 0.57 |
| ▸ | CA4 | P22748 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL4894489 | 0.93 | CA1 (0.64) | CA1CA4ALDH1A1TDP1CA2 | |
| Acetic Acid SCHEMBL887065 | 0.90 | CA1 (0.53) | CA1CA4ALDH1A1TDP1CA2 | |
| Acetic Acid SCHEMBL11579192 | 0.90 | CA1 (0.53) | CA1CA4ALDH1A1TDP1CA2 | |
| SCHEMBL4653890 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 | |
| Silver SCHEMBL25782 | 0.85 | — | — | |
| SCHEMBL25268289 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 | |
| SCHEMBL782854 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 | |
| SCHEMBL11543889 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 | |
| SCHEMBL3532262 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 | |
| SCHEMBL11705853 | 0.85 | CA1 (0.43) | CA1CA4CA2TSHRCYP3A4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1117518-B1 | FABRICATION OF THREE-DIMENSIONAL OBJECTS | STANFORD RES INST INT (US) | 2006-03-08 | — | — | EP | disclosed |
| US-20040005374-A1 | Creating objects through X and Z movement of print heads | NARANG SUBHASH (US) | 2004-01-08 | — | — | US | disclosed |
| EP-1117518-A4 | FABRICATION OF THREE-DIMENSIONAL OBJECTS | STANFORD RES INST INT (US) | 2003-01-29 | — | — | EP | disclosed |
| EP-1117518-A1 | FABRICATION OF THREE-DIMENSIONAL OBJECTS | SRI INTERNATIONAL (US) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000000335-A1 | FABRICATION OF THREE-DIMENSIONAL OBJECTS | SRI INTERNATIONAL (US) | 2000-01-06 | — | — | WO | disclosed |
| US-5980813-A | Rapid prototyping using multiple materials | SRI INTERNATIONAL (US) | 1999-11-09 | — | — | US | disclosed |