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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG known ✓ | P37231 | 3/20 | 0.45 |
| ▸ | CA2 known ✓ | P00918 | 1/20 | 0.44 |
| ▸ | ALOX5 known ✓ | P09917 | 1/20 | 0.43 |
| ▸ | CTRC | Q99895 | 1/20 | 0.55 |
| ▸ | CETP | P11597 | 3/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.45 |
| ▸ | PPARA | Q07869 | 2/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22497686 | 0.90 | CTRC (0.58) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL27269693 | 0.90 | CTRC (0.58) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL1358810 | 0.90 | CTRC (0.58) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL1358807 | 0.90 | CTRC (0.58) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL5508983 | 0.88 | CTRC (0.56) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL27700677 | 0.86 | CETP (0.51) | CTRCCETPHDAC2CNR2 | |
| SCHEMBL2638928 | 0.84 | CETP (0.50) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL28918374 | 0.84 | CTRC (0.53) | CTRCCETPHDAC2CNR2 | |
| SCHEMBL830484 | 0.84 | PPARG (0.57) | CTRCCETPHDAC2PPARGPPARA | |
| SCHEMBL30966217 | 0.84 | CTRC (0.53) | CTRCCETPHDAC2PPARGPPARA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0711746-A1 | Process for preparing hydroxycarboxylic acids | UNILEVER PLC (GB) | 1996-05-15 | — | — | EP | disclosed |
| US-5502226-A | SELECTIVE REDUCTION OF DIKETONE TO KETO ACIDS USING HYDROGEN IN THE PRESENCE OF BASE | ELIZABETH ARDEN CO., DIVISION OF CONOPCO, INC. (US) | 1996-03-26 | — | — | US | disclosed |