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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8014291 | 0.88 | RAB9A (0.32) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8459595 | 0.88 | RAB9A (0.32) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8014294 | 0.88 | RAB9A (0.32) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8128408 | 0.82 | RAB9A (0.35) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8455943 | 0.79 | RAB9A (0.32) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL6721441 | 0.76 | SMN1; SMN2 (0.34) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL6732599 | 0.73 | SMN1; SMN2 (0.35) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL7842848 | 0.69 | SMN1; SMN2 (0.37) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8132272 | 0.69 | SPR (0.39) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL8130838 | 0.69 | TNF (0.32) | RAB9ASMN1; SMN2ALDH1A1CYP1A2CYP2C19 |
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-0968649-A1 | Adjuvants for novel dry herbicide formulations | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-01-05 | — | — | EP | claimed |
| EP-0968649-A1 | Adjuvants for novel dry herbicide formulations | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-01-05 | — | — | EP | disclosed |