Known targets — ChEMBL curated mechanism
MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Triethyl Citrate. 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 | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Triethyl Citrate SCHEMBL901127 | 0.96 | GAA (0.48) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL23465 | 0.96 | GAA (0.48) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL22498818 | 0.94 | PKM (0.43) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL29035980 | 0.94 | GAA (0.46) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL28041956 | 0.94 | GAA (0.46) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL14856311 | 0.94 | GAA (0.46) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL6236671 | 0.94 | GAA (0.46) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL28185576 | 0.92 | GAA (0.44) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL5250346 | 0.90 | GAA (0.43) | GAAMGAMSIMGAM2PKM | |
| Triethyl Citrate SCHEMBL28853817 | 0.90 | GAA (0.43) | GAAMGAMSIMGAM2PKM |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115737578-A | Clopidogrel hydrogen sulfate and aspirin compound tablet and preparation method thereof | 石家庄四药有限公司 | 2023-03-07 | — | — | CN | claimed |
| US-20210299009-A1 | SILICONE OIL FREE ANTIPERSPIRANTS | HENKEL AG & CO. KGAA (DE) | 2021-09-30 | — | — | US | claimed |
| CN-106634084-A | Novel automobile skirt hem paint | 王娟 | 2017-05-10 | — | — | CN | claimed |
| CN-104587481-A | Preparation method of moisture-proof traditional Chinese medicine coated film | LIU TONGYAN | 2015-05-06 | — | — | CN | claimed |
| CN-115737578-A | Clopidogrel hydrogen sulfate and aspirin compound tablet and preparation method thereof | 石家庄四药有限公司 | 2023-03-07 | — | — | CN | disclosed |
| CN-109627458-B | Preparation method of quaternary ammonium group-containing (methyl) acrylate copolymer aqueous dispersion | 英德茂丰药业有限公司 | 2021-11-12 | — | — | CN | disclosed |
| CN-109627458-A | One kind containing the preparation method of quaternary ammonium group (methyl) acrylate copolymer aqueous dispersion | 英德茂丰药业有限公司 | 2019-04-16 | — | — | CN | disclosed |
| EP-2675438-B1 | EXTENDED RELEASE POWDER AND AQUEOUS SUSPENSION COMPRISING METHYLPHENIDATE | TRIS PHARMA INC (US) | 2019-04-10 | — | — | EP | disclosed |
| CN-106634084-A | Novel automobile skirt hem paint | 王娟 | 2017-05-10 | — | — | CN | disclosed |
| CN-106634084-A | Novel automobile skirt hem paint | 王娟 | 2017-05-10 | — | — | CN | disclosed |
| CN-106325010-A | Multi-constituent toner | 刘夕平 | 2017-01-11 | — | — | CN | disclosed |
| CN-106325010-A | Multi-constituent toner | 刘夕平 | 2017-01-11 | — | — | CN | disclosed |
| US-9386770-B2 | Use of predissolved pristinamycin-type and polyether ionophore type antimicrobial agents in the production of ethanol | Phibro Animal Health Corp. (US) | 2016-07-12 | — | — | US | disclosed |
| CN-104587481-A | Preparation method of moisture-proof traditional Chinese medicine coated film | LIU TONGYAN | 2015-05-06 | — | — | CN | disclosed |
| CN-101010070-A | Pharmaceutical composition | NOVARTIS AG (CH) | 2007-08-01 | — | — | CN | disclosed |
| CN-1935142-A | Slow-release capsule using noinclude, loratadine and pseudoephedrinesulfate as effective component, and its preparing method | FUKANGREN BIOPHARM SCI & RES (CN) | 2007-03-28 | — | — | CN | disclosed |
| CN-1853655-A | Oral colon target preparation for treating colitis ulcerativa and its making method | YANG MING (CN) | 2006-11-01 | — | — | CN | disclosed |