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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR9 known ✓ | Q9NR96 | 2/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.63 |
| ▸ | MAOB | P27338 | 3/20 | 0.56 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | F3 | P13726 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | GPR183 | P32249 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | CRHBP | P24387 | 1/20 | 0.44 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2020282 | 0.86 | HSD17B3 (0.67) | HSD17B3MAOBAPPF3MAPT | |
| SCHEMBL11137164 | 0.83 | MAOB (0.78) | HSD17B3MAOBF3MAPTKDM4E | |
| SCHEMBL11137160 | 0.83 | MAOB (0.78) | HSD17B3MAOBF3MAPTKDM4E | |
| Lithium Ion SCHEMBL8907286 | 0.83 | MAPT (0.54) | MAOBAPPMAPTKDM4EALDH1A1 | |
| SCHEMBL814395 | 0.80 | HSD17B3 (1.00) | HSD17B3MAOBAPPF3MAPT | |
| SCHEMBL3050207 | 0.80 | HSD17B3 (1.00) | HSD17B3MAOBAPPF3MAPT | |
| SCHEMBL814396 | 0.80 | HSD17B3 (1.00) | HSD17B3MAOBAPPF3MAPT | |
| SCHEMBL11143343 | 0.79 | F3 (0.77) | HSD17B3MAOBF3MAPTTLR9 | |
| SCHEMBL8409071 | 0.79 | F3 (0.77) | HSD17B3MAOBF3MAPTTLR9 | |
| SCHEMBL25211873 | 0.75 | MAOB (0.77) | MAOBMAPTTLR9MAOAMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0223373-B1 | WATER-SOLUBLE PHOTOINITIATORS | AUTOTYPE INTERNATIONAL LIMITED (GB) | 1990-04-18 | — | — | EP | disclosed |
| US-4824765-A | DIBENZALKETONES | AUTOTYPE INTERNATIONAL LIMITED, A BRITISH CO. (GB) | 1989-04-25 | — | — | US | disclosed |
| EP-0223373-A1 | Water-soluble photoinitiators | AUTOTYPE INTERNATIONAL LIMITED (GB) | 1987-05-27 | — | — | EP | disclosed |