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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PROKR1 | Q8TCW9 | 7/20 | 0.46 |
| ▸ | FPR2 | P25090 | 6/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7075149 | 0.97 | PROKR1 (0.48) | PROKR1FPR2F10LMNAMAPT | |
| SCHEMBL7074432 | 0.80 | HDAC4 (0.47) | PROKR1FPR2LMNAMAPTTHRB | |
| Acetic Acid SCHEMBL27525156 | 0.80 | HTT (0.52) | F10LMNAMAPTALDH1A1NPSR1 | |
| Acetic Acid SCHEMBL27552344 | 0.78 | F10 (0.60) | F10LMNAMAPTPOLB | |
| Acetic Acid SCHEMBL27525160 | 0.77 | F10 (0.62) | F10LMNAMAPTALDH1A1GAA | |
| Acetic Acid SCHEMBL27525182 | 0.76 | LMNA (0.71) | F10LMNAMAPTALDH1A1GAA | |
| Acetic Acid SCHEMBL28746462 | 0.76 | F10 (0.51) | F10LMNAALDH1A1POLB | |
| Acetic Acid SCHEMBL28744327 | 0.76 | LMNA (0.70) | F10LMNAMAPTALDH1A1GAA | |
| SCHEMBL7070540 | 0.76 | TSHR (0.54) | F10LMNAMAPTALDH1A1NPSR1 | |
| Acetic Acid SCHEMBL27568115 | 0.76 | F10 (0.64) | F10LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-1272107-A | Benzamidine derivatives as factor Xa inhibitors | MERCK PATENT GMBH (DE) | 2000-11-01 | — | — | CN | disclosed |