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 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.47 |
| ▸ | FYN | P06241 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | AHR | P35869 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL505806 | 0.96 | KMT2A (0.56) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL29503684 | 0.96 | KMT2A (0.56) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL29397724 | 0.96 | KMT2A (0.56) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL6584885 | 0.87 | KMT2A (0.44) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL6586507 | 0.87 | KMT2A (0.44) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL31302320 | 0.83 | CYP1A2 (0.44) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL5098468 | 0.83 | CYP1A2 (0.44) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL18393398 | 0.83 | CYP1A2 (0.56) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL975512 | 0.82 | CYP1A2 (0.53) | KMT2AMEN1CYP1A2ERBB2FYN | |
| SCHEMBL29980106 | 0.80 | KMT2A (0.62) | KMT2AMEN1CYP1A2ERBB2FYN |
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-6863701-B2 | Accelerators for cationic photopolymerizations | RENSSELAER POLYTECHNIC INSTITUTE (US) | 2005-03-08 | — | — | US | disclosed |
| EP-1483310-A1 | ACCELERATORS FOR CATIONIC PHOTOPOLYMERIZATION | RENSSELAER POLYTECHNIC INSTITUTE (US) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076491-A1 | ACCELERATORS FOR CATIONIC PHOTOPOLYMERIZATION | RENSSELAER POLYTECHNIC INSTITUTE (US) | 2003-09-18 | — | — | WO | disclosed |
| US-20030176519-A1 | Accelerators for cationic photopolymerizations | RENSSELAER POLYTECHNIC INSTITUTE | 2003-09-18 | — | — | US | disclosed |