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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 2/20 | 0.66 |
| ▸ | AURKA | O14965 | 1/20 | 0.60 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.60 |
| ▸ | TTR | P02766 | 2/20 | 0.51 |
| ▸ | SNCA | P37840 | 2/20 | 0.40 |
| ▸ | CHAT | P28329 | 1/20 | 0.40 |
| ▸ | ATIC | P31939 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.37 |
| ▸ | DUSP5 | Q16690 | 1/20 | 0.37 |
| ▸ | FABP4 | P15090 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | SENP2 | Q9HC62 | 4/20 | 0.35 |
| ▸ | SENP3 | Q9H4L4 | 3/20 | 0.35 |
| ▸ | SENP1 | Q9P0U3 | 3/20 | 0.35 |
| ▸ | SUMO2 | P61956 | 3/20 | 0.35 |
| ▸ | SUMO1 | P63165 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11429445 | 0.90 | NR4A1 (0.69) | NR4A1AURKAAURKBTTRCHAT | |
| SCHEMBL29516471 | 0.90 | NR4A1 (0.69) | NR4A1AURKAAURKBTTRCHAT | |
| SCHEMBL30822934 | 0.89 | AURKA (0.75) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL159399 | 0.89 | AURKA (0.75) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL30118457 | 0.87 | AURKA (0.73) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL11759180 | 0.87 | AURKA (0.73) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL11429443 | 0.87 | AURKA (0.73) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL9813360 | 0.83 | AURKA (0.72) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL11481679 | 0.83 | TTR (0.67) | NR4A1AURKAAURKBTTRSNCA | |
| SCHEMBL28747694 | 0.83 | NR4A1 (0.94) | NR4A1AURKAAURKBTTRSNCA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117986929-A | Room-temperature phosphorescent ink based on bio-based molecules-aromatic sulfonic acid or salts thereof, and preparation method and application thereof | 仲恺农业工程学院 | 2024-05-07 | — | — | CN | disclosed |