Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acrylic 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 | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | PYGL | P06737 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Acrylic Acid SCHEMBL2349998 | 0.91 | TDP1 (0.43) | KMT2APKMTDP1SMN1; SMN2STAT3 | |
| SCHEMBL31280644 | 0.89 | KMT2A (0.56) | KMT2APKMTDP1SMN1; SMN2STAT3 | |
| SCHEMBL344699 | 0.89 | KMT2A (0.56) | KMT2APKMTDP1SMN1; SMN2STAT3 | |
| SCHEMBL2345867 | 0.88 | KMT2A (0.55) | KMT2APKMTDP1SMN1; SMN2STAT3 | |
| SCHEMBL2345864 | 0.88 | KMT2A (0.55) | KMT2APKMTDP1SMN1; SMN2STAT3 | |
| SCHEMBL2345862 | 0.84 | TDP1 (0.49) | KMT2APKMTDP1SMN1; SMN2POLB | |
| SCHEMBL29381797 | 0.78 | MAPT (0.56) | KMT2APKMTDP1POLBRXFP1 | |
| SCHEMBL346822 | 0.78 | MAPT (0.56) | KMT2APKMTDP1POLBRXFP1 | |
| SCHEMBL3632249 | 0.77 | TDP1 (0.54) | KMT2APKMTDP1POLBRXFP1 | |
| SCHEMBL2362927 | 0.77 | SMN1; SMN2 (0.43) | KMT2APKMTDP1SMN1; SMN2STAT3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7560032-B2 | High molecular weight polymers containing pendant salicylic acid groups for clarifying Bayer process liquors | NALCO COMPANY (US) | 2009-07-14 | — | — | US | disclosed |
| EP-1363716-B1 | METHOD OF CLARIFYING BAYER PROCESS LIQUORS USING SALICYLIC ACID CONTAINING POLYMERS | ONDEO NALCO CO (US) | 2008-10-15 | — | — | EP | disclosed |
| EP-1597301-B1 | HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS | NALCO CO (US) | 2008-04-09 | — | — | EP | disclosed |
| US-20060273040-A1 | High molecular weight polymers containing pendant salicylic acid groups for clarifying Bayer process liquors | ECOLAB USA INC. | 2006-12-07 | — | — | US | disclosed |
| EP-1597301-A4 | HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS | NALCO CO (US) | 2006-05-17 | — | — | EP | disclosed |
| EP-1597301-A2 | HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS | Nalco Company (US) | 2005-11-23 | — | — | EP | disclosed |
| WO-2004076510-A2 | HIGH MOLECULAR WEIGHT POLYMERS CONTAINING PENDENT SALICYCLIC ACID GROUPS FOR CLARIFYING BAYER PROCESS LIQUORS | NALCO COMPANY (US) | 2004-09-10 | — | — | WO | disclosed |