Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. 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 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL285412 | 0.96 | KMT2A (0.50) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| Potassium Ion SCHEMBL190393 | 0.96 | KMT2A (0.50) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| Water SCHEMBL28916296 | 0.94 | KMT2A (0.49) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| SCHEMBL29463334 | 0.87 | KMT2A (0.44) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| SCHEMBL4022653 | 0.84 | KEAP1 (0.48) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| Potassium Ion SCHEMBL9673910 | 0.84 | KEAP1 (0.48) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| SCHEMBL161682 | 0.84 | KEAP1 (0.48) | KMT2AMEN1GLAALDH1A1KEAP1 | |
| Hydrochloric Acid SCHEMBL30888463 | 0.82 | KEAP1 (0.47) | KMT2AMEN1GLAKEAP1SMN1; SMN2 | |
| SCHEMBL23780018 | 0.81 | THRB (0.40) | KMT2AMEN1ALDH1A1KEAP1SMN1; SMN2 | |
| SCHEMBL28572354 | 0.80 | MEN1 (0.55) | KMT2AMEN1GLAALDH1A1KEAP1 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1111065-B1 | Production of saccharide carboxylic acids | ENSUIKO SUGAR REFINING (JP) | 2007-09-26 | — | — | EP | disclosed |
| EP-0599646-B1 | Production of saccharide carboxylic acids | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2002-09-18 | — | — | EP | disclosed |
| EP-1111065-A2 | Production of saccharide carboxylic acids | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-27 | — | — | EP | disclosed |
| EP-0657176-B1 | Composition containing a water-insoluble or slightly water-soluble compound with enhanced water-solubility | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2000-09-20 | — | — | EP | disclosed |
| US-5840881-A | ADDING A BRANCHED CYCLODEXTRIN-CARBOXYLIC ACID | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-11-24 | — | — | US | disclosed |
| US-5635611-A | COMPLEXING DETRANYLGLUCURONIC ACID SALT WITH FERRIC HYDROXIDE SOL TO FORM A COMPLEX; RESISTANT TO ENZYMATIC DEGRADATION AND IMPROVED WATER SOLUBILITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-06-03 | — | — | US | disclosed |
| US-5635610-A | FROM OXIDATION BY A MICROORGANISM BELONGING TO THE GENUS PSEUDOGLUCONOBACTER; RESISTANT TO ENZYMATIC DEGRADATION; IMPROVED WATER SOLUBILITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-06-03 | — | — | US | disclosed |
| US-5629411-A | RESISTANT TO ENZYMATIC DEGRATION, IMPROVED WATER SOLUBILITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-05-13 | — | — | US | disclosed |
| US-5434061-A | Pseudogluconobacter | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-07-18 | — | — | US | disclosed |
| EP-0657176-A2 | Composition containing a water-insoluble or slightly water-soluble compound with enhanced water-solubility | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-06-14 | — | — | EP | disclosed |
| EP-0634174-A1 | Antianemic composition for veterinary use | Takeda Chemical Industries, Ltd. (JP) | 1995-01-18 | — | — | EP | disclosed |
| EP-0599646-A2 | Production of saccharide carboxylic acids | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-06-01 | — | — | EP | disclosed |