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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 known ✓ | P00915 | 2/20 | 0.41 |
| ▸ | CA2 known ✓ | P00918 | 2/20 | 0.39 |
| ▸ | FDPS known ✓ | P14324 | 4/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11223474 | 0.98 | RECQL (0.44) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL17710323 | 0.93 | CA2 (0.38) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL3381883 | 0.77 | CA2 (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL9660940 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL9756753 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL28620924 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL3386052 | 0.76 | CA2 (0.50) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL17219439 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL17336061 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD | |
| SCHEMBL8688848 | 0.76 | RECQL (0.47) | NR1I2RECQLCA1GLAHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112795002-B | Polyether anionic and nonionic surfactant containing heteroatom and preparation method thereof | 中国石油化工股份有限公司 | 2022-04-01 | — | — | CN | disclosed |
| WO-2021093601-A1 | SURFACTANT AND PREPARATION METHOD THEREFOR | 中国石油化工股份有限公司 | 2021-05-20 | — | — | WO | disclosed |
| CN-112795002-A | Alkoxy polyether anionic and nonionic surfactant containing heteroatom and preparation method thereof | 中国石油化工股份有限公司 | 2021-05-14 | — | — | CN | disclosed |