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 | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 4/20 | 0.41 |
| ▸ | TLR9 known ✓ | Q9NR96 | 1/20 | 0.41 |
| ▸ | EDNRB known ✓ | P24530 | 2/20 | 0.40 |
| ▸ | EDNRA known ✓ | P25101 | 2/20 | 0.40 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.38 |
| ▸ | CA1 known ✓ | P00915 | 2/20 | 0.35 |
| ▸ | CA4 known ✓ | P22748 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | CTSL | P07711 | 2/20 | 0.40 |
| ▸ | CTSS | P25774 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | CTSC | P53634 | 1/20 | 0.40 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SLC7A11 | Q9UPY5 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6914542 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6907770 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6912839 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6914451 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6912831 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6913341 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| Zinc Ion SCHEMBL6909025 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL6913062 | 0.96 | LMNA (0.42) | LMNACA2HSP90AA1TLR9S100A4 | |
| SCHEMBL10454714 | 0.84 | CA2 (0.50) | LMNACA2FTOALDH1A1SLC7A11 | |
| SCHEMBL3944419 | 0.83 | CA2 (0.44) | LMNACA2FTOALDH1A1SLC7A11 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5118739-A | Flame retardant macromolecular materials containing brominated aromatic sulfonic acid salts | ETHYL CORPORATION (US) | 1992-06-02 | — | — | US | claimed |
| US-20120302725-A1 | POLYARYLENE IONOMERS | E I DU PONT DE NEMOURS AND COMPANY (US) | 2012-11-29 | — | — | US | disclosed |
| CN-102686639-A | Polyarylene ionomers | DU PONT | 2012-09-19 | — | — | CN | disclosed |
| CN-102686623-A | Polyarylene ionomer membranes | DU PONT | 2012-09-19 | — | — | CN | disclosed |
| US-5256742-A | Preparation of poly(arylene sulfide)s from poly(arylene sulfide disulfide) | PHILLIPS PETROLEUM COMPANY (US) | 1993-10-26 | — | — | US | disclosed |
| US-4370470-A | Multistage, agitated contactor and its use in continuous production of arylene sulfide polymer | PHILLIPS PETROLEUM COMPANY (US) | 1983-01-25 | — | — | US | disclosed |
| EP-0044184-A2 | Blend of polyarylene sulfide and wholly aromatic polyester | CELANESE CORPORATION (US) | 1982-01-20 | — | — | EP | disclosed |
| US-4276397-A | IMPROVED PROCESSABILITY TO FORM MOLDED ARTICLES | CELANESE CORPORATION (US) | 1981-06-30 | — | — | US | disclosed |