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.
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 | |
|---|---|---|---|---|
| SCHEMBL28811601 | 0.80 | — | — | |
| SCHEMBL3947698 | 0.66 | — | — | |
| SCHEMBL31484730 | 0.57 | — | — | |
| SCHEMBL5329389 | 0.55 | — | — | |
| Sulfuric Acid SCHEMBL27713825 | 0.48 | ALDH1A1 (0.55) | — | |
| Benzoquinone SCHEMBL28528776 | 0.46 | ALDH1A1 (0.57) | — | |
| Sulfamate SCHEMBL644082 | 0.45 | — | — | |
| Sulfamate SCHEMBL16034628 | 0.45 | CA1 (0.50) | — | |
| Sulfuric Acid SCHEMBL3928573 | 0.45 | — | — | |
| SCHEMBL6928129 | 0.45 | TSHR (0.50) | — |
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-117510385-A | Chain transfer agent for polycarboxylate superplasticizer, application and preparation method thereof | 科之杰新材料集团(贵州)有限公司 | 2024-02-06 | — | — | CN | claimed |
| CN-117510385-A | Chain transfer agent for polycarboxylate superplasticizer, application and preparation method thereof | 科之杰新材料集团(贵州)有限公司 | 2024-02-06 | — | — | CN | disclosed |
| CN-114014788-B | Chain transfer agent for polycarboxylate superplasticizer, application and preparation method thereof | 科之杰新材料集团(贵州)有限公司 | 2023-10-10 | — | — | CN | disclosed |