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 | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.42 |
| ▸ | P2RY2 known ✓ | P41231 | 1/20 | 0.40 |
| ▸ | P2RY6 known ✓ | Q15077 | 1/20 | 0.40 |
| ▸ | P2RY12 known ✓ | Q9H244 | 1/20 | 0.39 |
| ▸ | P2RY4 known ✓ | P51582 | 1/20 | 0.36 |
| ▸ | TLR4 known ✓ | O00206 | 1/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11526965 | 0.88 | DUSP5 (0.41) | P2RY2P2RY6GAAKMT2AL3MBTL1 | |
| SCHEMBL9011400 | 0.86 | CASP1 (0.47) | PTGS2CTNNB1LMNAP2RY2P2RY6 | |
| Diphenylether SCHEMBL28558516 | 0.80 | SOS1 (0.53) | LMNAP2RY2P2RY6SOS1HTT | |
| SCHEMBL4962918 | 0.79 | SOS1 (0.44) | LMNAP2RY2P2RY6SOS1KMT2A | |
| SCHEMBL8142679 | 0.78 | LTA4H (0.42) | PTGS2LMNAKMT2APOLBMAPT | |
| SCHEMBL28898922 | 0.78 | DUSP5 (0.44) | LMNAGAAKMT2A | |
| SCHEMBL512464 | 0.76 | CASP1 (0.44) | PTGS2CTNNB1LMNACASP1GAA | |
| SCHEMBL11600047 | 0.75 | CASP1 (0.43) | PTGS2CTNNB1LMNACASP1SOS1 | |
| SCHEMBL6053382 | 0.75 | POLB (0.41) | PTGS2CTNNB1LMNACASP1SOS1 | |
| SCHEMBL29352063 | 0.74 | DUSP5 (0.44) | LMNAP2RY2CASP1P2RY12MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120009379-A1 | Vinyl Acetate-Ethylene-Copolymer Dispersions and Textile Web Material Treated herewith | CELANESE EMULSIONS GMBH (DE) | 2012-01-12 | — | — | US | disclosed |
| EP-0515871-B1 | Multiple stage graft copolymer and its use in the preparation of PVC mouldings | BASF AG (DE) | 1995-08-02 | — | — | EP | disclosed |
| EP-0515871-A1 | Multiple stage graft copolymer and its use in the preparation of PVC mouldings | BASF Aktiengesellschaft (DE) | 1992-12-02 | — | — | EP | disclosed |
| EP-0024014-B1 | METHOD OF RETANNING MINERAL TANNED LEATHER WITH AROMATIC SULFONIC ACIDS | BAYER AG (DE) | 1982-05-19 | — | — | EP | disclosed |
| EP-0024014-A1 | Method of retanning mineral tanned leather with aromatic sulfonic acids | BAYER AG (DE) | 1981-02-18 | — | — | EP | disclosed |