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 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 known ✓ | Q92731 | 2/20 | 0.39 |
| ▸ | F11 | P03951 | 9/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL974086 | 0.91 | GAA (0.46) | F11MEN1ESR1GAAKMT2A | |
| SCHEMBL7159703 | 0.88 | GAA (0.50) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL4094195 | 0.85 | ELANE (0.40) | F11SMN1; SMN2NFKB1NFE2L2 | |
| SCHEMBL28119137 | 0.83 | KMT2A (0.46) | MEN1GAAKMT2A | |
| Methane SCHEMBL27611186 | 0.81 | KMT2A (0.45) | MEN1GAAKMT2A | |
| SCHEMBL7156677 | 0.80 | ESR1 (0.62) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL8321795 | 0.80 | CTSB (0.39) | F11MEN1ESR1GAAKMT2A | |
| SCHEMBL18532775 | 0.76 | ELANE (0.57) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL6940400 | 0.76 | KMT2A (0.44) | MEN1ESR1GAAKMT2AESR2 | |
| SCHEMBL10884908 | 0.76 | CA12 (0.54) | MEN1KMT2ASMN1; SMN2NFKB1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7875412-B2 | silanetriol sulfonate complexes; for printers, copiers, facsimile machines; improved durability and environmental resistance | ORIENT CHEMICAL INDUSTRIES, LTD. (JP) | 2011-01-25 | — | — | US | disclosed |
| EP-1843214-A1 | Positive electrified charge control agent and positive electrified toner for developing electrostatic image | Orient Chemical Industries, Ltd. (JP) | 2007-10-10 | — | — | EP | disclosed |
| US-20070231726-A1 | Positive electrified charge control agent and positive electrified toner for developing electrostatic image | ORIENT CHEMICAL INDUSTRIES, LTD. (JP) | 2007-10-04 | — | — | US | disclosed |