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 | |
|---|---|---|---|---|
| ▸ | P2RY2 known ✓ | P41231 | 1/20 | 0.46 |
| ▸ | CA2 known ✓ | P00918 | 3/20 | 0.45 |
| ▸ | CA12 known ✓ | O43570 | 1/20 | 0.45 |
| ▸ | CA1 known ✓ | P00915 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.56 |
| ▸ | NT5E | P21589 | 1/20 | 0.52 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9225420 | 0.85 | NT5E (0.67) | L3MBTL1HPGDALOX12NT5ECXCR2 | |
| SCHEMBL10720749 | 0.80 | MAPT (0.63) | L3MBTL1HPGDKMT2AMAPTMEN1 | |
| SCHEMBL29357322 | 0.78 | MAPT (0.57) | L3MBTL1HPGDALOX12KMT2AMAPT | |
| SCHEMBL141079 | 0.78 | MAPT (0.57) | L3MBTL1HPGDALOX12KMT2AMAPT | |
| SCHEMBL9223945 | 0.77 | HPGD (0.61) | L3MBTL1HPGDALOX12NT5ECXCR2 | |
| SCHEMBL5718635 | 0.76 | MAPK1 (0.77) | L3MBTL1HPGDALOX12CXCR2KMT2A | |
| SCHEMBL8765310 | 0.74 | MAPT (0.67) | L3MBTL1HPGDALOX12NT5ECXCR2 | |
| SCHEMBL11408774 | 0.74 | L3MBTL1 (0.62) | L3MBTL1HPGDALOX12CXCR2KMT2A | |
| SCHEMBL30499873 | 0.74 | L3MBTL1 (0.62) | L3MBTL1HPGDALOX12CXCR2KMT2A | |
| SCHEMBL11025851 | 0.74 | L3MBTL1 (0.62) | L3MBTL1HPGDALOX12CXCR2KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5380456-A | Aromatic aminosulfonic acid, liquid bleach | UNITED STATES BORAX & CHEMICAL CORPORATION (US) | 1995-01-10 | — | — | US | disclosed |
| WO-1991011388-A1 | STABILIZATION OF AQUEOUS PEROXYGEN SOLUTIONS | UNITED STATES BORAX & CHEMICAL CORPORATION (US) | 1991-08-08 | — | — | WO | disclosed |