Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A known ✓ | P27815 | 1/20 | 0.42 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8967965 | 0.94 | LMNA (0.50) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Mannitol SCHEMBL27645017 | 0.78 | LMNA (0.73) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| SCHEMBL29020598 | 0.78 | LMNA (0.46) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Lithium Ion SCHEMBL10340067 | 0.76 | LMNA (0.44) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Mannitol SCHEMBL27789598 | 0.75 | LMNA (0.77) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Citric Acid SCHEMBL21807344 | 0.74 | CA4 (0.65) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Citric Acid SCHEMBL21807340 | 0.74 | CA4 (0.65) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| SCHEMBL6668472 | 0.74 | LMNA (0.47) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| SCHEMBL11501996 | 0.74 | LMNA (0.47) | LMNAL3MBTL1TDP1PDE4AUSP2 | |
| Sorbitol SCHEMBL31346584 | 0.73 | LMNA (0.67) | LMNAL3MBTL1TDP1PDE4AUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5584944-A | FRICTION RESISTANCE; LOW TEMPERATURE DRYING; BEVERAGE CONTAINERS | HENKEL CORPORATION (US) | 1996-12-17 | — | — | US | disclosed |
| US-5486316-A | Aqueous lubricant and surface conditioner for formed metal surfaces | HENKEL CORPORATION (US) | 1996-01-23 | — | — | US | disclosed |
| US-5476601-A | Additive consists of quaternary ammonium salt and amine oxide, complex fluoride ions, optionally phosphate ions including sulfate and nitrate ions, aluminate anion and aluminum cation, water solulbe polymer and antifome agent | HENKEL CORPORATION (US) | 1995-12-19 | — | — | US | disclosed |
| US-5458698-A | Aluminum and tin beverage containers | HENKEL CORPORATION (US) | 1995-10-17 | — | — | US | disclosed |