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 | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 3/20 | 0.72 |
| ▸ | CDC25A | P30304 | 2/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.72 |
| ▸ | ESR1 | P03372 | 1/20 | 0.72 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.72 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.72 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.72 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.72 |
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.59 |
| ▸ | LPAR2 | Q9HBW0 | 5/20 | 0.59 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.59 |
| ▸ | TERT | O14746 | 1/20 | 0.54 |
| ▸ | UCHL3 | P15374 | 1/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.54 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.50 |
| ▸ | PRKCG | P05129 | 1/20 | 0.50 |
| ▸ | PRKCB | P05771 | 1/20 | 0.50 |
| ▸ | PRKCA | P17252 | 1/20 | 0.50 |
| ▸ | PRKCH | P24723 | 1/20 | 0.50 |
| ▸ | PRKCI | P41743 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9628276 | 1.00 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL11321508 | 1.00 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL11437384 | 1.00 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL8337002 | 1.00 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL9562149 | 1.00 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL11806152 | 0.98 | AKT1 (0.69) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL23706702 | 0.95 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| Potassium Ion SCHEMBL7157363 | 0.95 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL641286 | 0.95 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 | |
| SCHEMBL673085 | 0.95 | AKT1 (0.72) | AKT1CDC25ALMNAESR1ADORA3 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5222068-A | — | — | None | — | — | JP | disclosed |
| CN-104800101-B | Cosmetic | 信越化学工业株式会社 | 2018-01-23 | — | — | CN | disclosed |
| CN-103371930-B | Oil base cosmetic cosmetic product | 信越化学工业株式会社 | 2017-06-23 | — | — | CN | disclosed |
| CN-104800101-A | Cosmetics | SHINETSU CHEMICAL CO | 2015-07-29 | — | — | CN | disclosed |
| JP-H05222068-A | PRODUCTION OF METALLIC SALT OF PHOSPHORIC ESTER | KAO CORP | 1993-08-31 | — | — | JP | disclosed |
| EP-0321786-B1 | COMPOSITION FOR EXTERNAL APPLICATION | KAO CORPORATION (JP) | 1993-05-19 | — | — | EP | disclosed |
| EP-0201040-B1 | COSMETICS COMPRISING AN OIL-GELLING AGENT | Kao Corporation (JP) | 1991-11-13 | — | — | EP | disclosed |
| EP-0321786-A2 | Composition for external application | KAO CORPORATION (JP) | 1989-06-28 | — | — | EP | disclosed |
| US-4791140-A | GELATION WITH METAL SALT OF DIALKYL PHOSPHATE | KAO CORPORATION (JP) | 1988-12-13 | — | — | US | disclosed |
| EP-0201040-A2 | Cosmetics comprising an oil-gelling agent | Kao Corporation (JP) | 1986-11-12 | — | — | EP | disclosed |