Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Hexane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR3 | Q9UBY5 | 6/20 | 0.63 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.63 |
| ▸ | FDPS | P14324 | 12/20 | 0.57 |
| ▸ | GGPS1 | O95749 | 4/20 | 0.55 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.55 |
| ▸ | LAP3 | P28838 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL18769800 | 1.00 | LPAR3 (0.63) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Hexane SCHEMBL27668811 | 1.00 | LPAR3 (0.63) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Decane SCHEMBL5015979 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Dodecane SCHEMBL11581918 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Octane SCHEMBL9461155 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Decane SCHEMBL16986478 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Hexadecane SCHEMBL3437134 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Octane SCHEMBL4445679 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Octane SCHEMBL21854612 | 0.96 | LPAR3 (0.68) | LPAR3LPAR2FDPSGGPS1LPAR1 | |
| Hexane SCHEMBL8829468 | 0.96 | LPAR3 (0.60) | LPAR3LPAR2FDPSGGPS1LPAR1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116655683-A | Antifungal nanomaterial based on dynamic covalent bond and preparation method and application thereof | 国科温州研究院(温州生物材料与工程研究所) | 2023-08-29 | — | — | CN | disclosed |
| US-6797678-B2 | OBTAINED BY HEATING AN ACIDIC PHOSPHATE ESTER AND/OR A PHOSPHITE ESTER AND AN IMIDE-BASED DISPERSANT (SUCH AS POLYBUTENYL SUCCINIMIDE) CONTAINING BORON; WEAR RESISTANCE, SCORING RESISTANCE AND PROLONGS SURFACE FATIGUE LIFE | IDEMITSU KOSAN CO., LTD. (JP) | 2004-09-28 | — | — | US | disclosed |
| US-20020165102-A1 | Lubricating oil composition for cellulose base wet friction material | IDEMITSU KOSAN CO., LTD. (JP) | 2002-11-07 | — | — | US | disclosed |
| US-20020055441-A1 | Lubricant additive | IDEMITSU KOSAN CO., LTD. (JP) | 2002-05-09 | — | — | US | disclosed |
| US-6352962-B1 | ADDITIVE FOR TRACTION DRIVE FLUID OBTAINED BY HEATING AT LEAST ONE ESTER SELECTED FROM ACIDIC PHOSPHATE ESTER AND PHOSPHITE ESTER AND SUCCINIMIDE DISPERSANT CONTAINING BORON AT TEMPERATURE OF 120 TO 150 DEGREES C. FOR 5 HOURS OR MORE | IDEMITSU KOSAN CO., LTD. (JP) | 2002-03-05 | — | — | US | disclosed |
| US-6303546-B1 | CONTAINING PHOSPHATE ESTER, BORON-CONTAINING IMIDE BASE DISPERSANT AND BORON-FREE IMIDE BASE DISPERSANT | IDEMITSU KOSAN CO., LTD. (JP) | 2001-10-16 | — | — | US | disclosed |
| EP-1142983-A1 | Lubricant additive | IDEMITSU KOSAN COMPANY LIMITED (JP) | 2001-10-10 | — | — | EP | disclosed |
| EP-1057884-A1 | Traction drive fluid | IDEMITSU KOSAN COMPANY LIMITED (JP) | 2000-12-06 | — | — | EP | disclosed |
| EP-1057882-A1 | Lubricating oil composition for cellulose base wet friction material | IDEMITSU KOSAN CO., LTD. (JP) | 2000-12-06 | — | — | EP | disclosed |