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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 known ✓ | O43570 | 3/20 | 0.41 |
| ▸ | CA2 known ✓ | P00918 | 3/20 | 0.41 |
| ▸ | CA1 known ✓ | P00915 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.42 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2488308 | 0.79 | LMNA (0.50) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL7875002 | 0.79 | LMNA (0.50) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL28111816 | 0.78 | LMNA (0.54) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| Sulfuric Acid SCHEMBL27672617 | 0.78 | LMNA (0.48) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL11687409 | 0.78 | LMNA (0.54) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL10638198 | 0.78 | LMNA (0.48) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL12237251 | 0.76 | HSD11B1 (0.71) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL28748984 | 0.76 | HSD11B1 (0.71) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| SCHEMBL28397073 | 0.76 | HSD11B1 (0.71) | LMNAKDM4EL3MBTL1HSD11B1AOC3 | |
| Sulfuric Acid SCHEMBL28213387 | 0.76 | AOC3 (0.47) | LMNAKDM4EL3MBTL1HSD11B1AOC3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4725499-A | COPOLYMER OF A 2-ACRYLAMIDO-2-PHENYLSULFONIC ACID; PIGMENT DISPERSANTS; | MITSUI TOATSU CHEMICALS, INC. (JP) | 1988-02-16 | — | — | US | disclosed |
| US-4701283-A | FROM AN UNSATURATED NITRILE AND B-HYDROXYALKANESULFONIC ACID IN FUMING SULFURIC ACID | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1987-10-20 | — | — | US | disclosed |
| US-4659773-A | COPOLYMERIZING EMULSION WITH A RADICAL POLYMERIZABLE UNSATURATED BOND | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1987-04-21 | — | — | US | disclosed |
| EP-0112921-A1 | PROCESS FOR PREPARING AMIDOALKANESULFONIC ACID DERIVATIVES | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1984-07-11 | — | — | EP | disclosed |