Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Propanol. 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 | |
|---|---|---|---|---|
| Propanol SCHEMBL28292919 | 0.92 | — | — | |
| Propanol SCHEMBL2482494 | 0.92 | ALDH1A1 (0.41) | — | |
| Propanol SCHEMBL29968655 | 0.89 | ALDH1A1 (0.39) | — | |
| Propanol SCHEMBL11326667 | 0.89 | ALDH1A1 (0.39) | — | |
| Propanol SCHEMBL16762189 | 0.89 | ALDH1A1 (0.39) | — | |
| Propanol SCHEMBL5361074 | 0.84 | — | — | |
| SCHEMBL20174 | 0.83 | — | — | |
| Alcohol SCHEMBL21808180 | 0.80 | ALDH1A1 (0.50) | — | |
| Alcohol SCHEMBL28202541 | 0.80 | ALDH1A1 (0.50) | — | |
| Propanol SCHEMBL28673986 | 0.80 | ALDH1A1 (0.44) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117903012-A | Preparation method of mesylate product | 河北圣泰材料股份有限公司 | 2024-04-19 | — | — | CN | claimed |
| CN-108641019-B | Rosin-based thiolated polyvinyl chloride comb polymer and preparation method and application thereof | 中国林业科学研究院林产化学工业研究所 | 2020-02-18 | — | — | CN | claimed |
| CN-109734593-A | A kind of preparation method of 3- propoxyl group propyl propionate | 韶关市合众化工有限公司 | 2019-05-10 | — | — | CN | claimed |
| CN-108641019-A | A kind of polyvinyl chloride comb-shaped polymer and its preparation method and application that abietyl is Thiolation | 中国林业科学研究院林产化学工业研究所 | 2018-10-12 | — | — | CN | claimed |
| CN-117903012-A | Preparation method of mesylate product | 河北圣泰材料股份有限公司 | 2024-04-19 | — | — | CN | disclosed |
| CN-108641019-B | Rosin-based thiolated polyvinyl chloride comb polymer and preparation method and application thereof | 中国林业科学研究院林产化学工业研究所 | 2020-02-18 | — | — | CN | disclosed |
| CN-106187709-B | A kind of preparation method of 1- hydroxyl pyrene | 上海引盛生物科技有限公司 | 2019-10-11 | — | — | CN | disclosed |
| CN-109734593-A | A kind of preparation method of 3- propoxyl group propyl propionate | 韶关市合众化工有限公司 | 2019-05-10 | — | — | CN | disclosed |
| CN-108641019-A | A kind of polyvinyl chloride comb-shaped polymer and its preparation method and application that abietyl is Thiolation | 中国林业科学研究院林产化学工业研究所 | 2018-10-12 | — | — | CN | disclosed |
| CN-106187709-A | A kind of preparation method of 1 hydroxyl pyrene | 江苏晶化天成新材料科技有限公司 | 2016-12-07 | — | — | CN | disclosed |