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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 known ✓ | P00918 | 6/20 | 0.39 |
| ▸ | CA1 known ✓ | P00915 | 4/20 | 0.39 |
| ▸ | FDPS known ✓ | P14324 | 1/20 | 0.33 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL639496 | 0.86 | CA1 (0.42) | CA2CA1FDPSOPRM1 | |
| SCHEMBL148000 | 0.86 | CA1 (0.42) | CA2CA1FDPSOPRM1 | |
| SCHEMBL673122 | 0.86 | CA1 (0.42) | CA2CA1FDPSOPRM1 | |
| SCHEMBL672387 | 0.86 | OPRM1 (0.44) | CA2CA1FDPSOPRM1 | |
| Potassium Ion SCHEMBL28523460 | 0.80 | — | — | |
| SCHEMBL14244957 | 0.77 | DNM1 (0.38) | CA2CA1DNM1TSHRSMN1; SMN2 | |
| SCHEMBL2512164 | 0.73 | — | — | |
| Phosphonic Acid SCHEMBL7193174 | 0.72 | DNM1 (0.57) | CA2CA1DNM1TSHRSMN1; SMN2 | |
| SCHEMBL18245471 | 0.71 | CA2 (0.40) | CA2CA1DNM1TSHRSMN1; SMN2 | |
| SCHEMBL18245473 | 0.71 | CA2 (0.40) | CA2CA1DNM1TSHRSMN1; SMN2 |
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-6534673-B1 | Reacting alkylphosphonous acid, hypophosphorous acid and/or alkali metal salts thereof with olefins in presence of azo compound free radical initiator to give dialkylphosphinic acids and/or salts thereof, reacting with metal compounds | CLARIANT GMBH (DE) | 2003-03-18 | — | — | US | disclosed |
| US-6355832-B1 | FREE-RADICAL CATALYSTS AND DIALKYLPHOSPHINIC ACID SALT FORMATION | CLARIANT GMBH (DE) | 2002-03-12 | — | — | US | disclosed |