Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Acrylic Acid Ethyl Ester. 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 | |
|---|---|---|---|---|
| ▸ | PPARG known ✓ | P37231 | 2/20 | 0.48 |
| ▸ | ADORA3 known ✓ | P0DMS8 | 2/20 | 0.41 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.40 |
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.40 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.40 |
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.40 |
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.39 |
| ▸ | DHFR known ✓ | P00374 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28332916 | 0.83 | THRB (0.44) | PPARGGAAKMT2AMEN1LMNA | |
| Potassium Ion SCHEMBL9644413 | 0.82 | THRB (0.42) | PPARGGAAKMT2AMEN1LMNA | |
| Acrylic Acid SCHEMBL28294518 | 0.81 | HDAC3 (0.46) | PPARGGAAKMT2ALMNASMN1; SMN2 | |
| Styrene SCHEMBL6233551 | 0.80 | TSHR (0.45) | PPARGGAAKMT2AMEN1LMNA | |
| Acrylic Acid SCHEMBL6279451 | 0.80 | HTT (0.42) | PPARGGAAKMT2AMEN1LMNA | |
| Acrylic Acid Ethyl Ester SCHEMBL27418504 | 0.79 | LMNA (0.51) | PPARGGAAKMT2AMEN1CTDSP1 | |
| Cinnamic Acid SCHEMBL27833785 | 0.79 | HCAR2 (0.58) | KMT2AMEN1CTDSP1RAB9ALMNA | |
| Acrylamide SCHEMBL9325809 | 0.79 | HTT (0.41) | PPARGGAAKMT2AMEN1LMNA | |
| Acrylic Acid Methyl Ester SCHEMBL28726005 | 0.79 | HTT (0.39) | PPARGGAAKMT2ARAB9ALMNA | |
| Styrene SCHEMBL138624 | 0.78 | MEN1 (0.53) | GAAKMT2AMEN1CTDSP1ADORA3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0048447-B1 | PROCESS FOR PREPARING SILYLATED ORGANIC POLYMERS AND THEIR USE FOR TREATING TEXTILE MATERIALS | SWS Silicones Corporation (US) | 1985-05-02 | — | — | EP | disclosed |
| US-4401698-A | SILYLATED POLYETHERAMINES | SWS SILICONES CORPORATION (US) | 1983-08-30 | — | — | US | disclosed |
| US-4352917-A | REACTING SILYLATED AMINOPOLYETHER WITH AN ACRYLIC ACID POLYMER | SWS SILICONES CORPORATION (US) | 1982-10-05 | — | — | US | disclosed |
| EP-0048447-A2 | Process for preparing silylated organic polymers and their use for treating textile materials | SWS Silicones Corporation (US) | 1982-03-31 | — | — | EP | disclosed |