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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.48 |
| ▸ | STS | P08842 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4606124 | 0.96 | TSHR (0.59) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4605747 | 0.96 | TSHR (0.59) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4604221 | 0.96 | TSHR (0.59) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4603546 | 0.92 | TSHR (0.58) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4605029 | 0.92 | TSHR (0.58) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4604586 | 0.92 | TSHR (0.58) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL9133233 | 0.88 | S1PR3 (0.62) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL28152727 | 0.88 | S1PR3 (0.62) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL27875109 | 0.86 | TSHR (0.60) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL4605459 | 0.86 | ALDH1A1 (0.56) | TSHRALDH1A1LMNATP53CYP3A4 |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109180918-B | A kind of copoly type high flow polyester master batch basis material and preparation method thereof | 东华大学 | 2019-09-13 | — | — | CN | claimed |
| CN-109422869-A | One kind being suitable for terylene filament fabric soft coating water-soluble polyester and preparation method thereof | 四川瀚洲化工科技有限公司 | 2019-03-05 | — | — | CN | claimed |
| CN-109180918-A | A kind of copoly type high flow polyester master batch basis material and preparation method thereof | 东华大学 | 2019-01-11 | — | — | CN | claimed |
| CN-105939660-B | Signal of organism detects dress material | 日本电信电话株式会社 | 2019-07-26 | — | — | CN | disclosed |
| CN-106832266-B | A kind of aqueous polyurethane and UV-curable waterborne polyurethane coating and preparation method thereof | 广东工业大学 | 2019-05-24 | — | — | CN | disclosed |
| CN-109485838-A | Copoly type high fluidity cationic polyester master batch basis material and preparation method thereof | 东华大学 | 2019-03-19 | — | — | CN | disclosed |
| CN-109456468-A | Hydrophilic easy-to-dye polyester master batch basis material of copoly type high fluidity and preparation method thereof | 东华大学 | 2019-03-12 | — | — | CN | disclosed |
| CN-109422869-A | One kind being suitable for terylene filament fabric soft coating water-soluble polyester and preparation method thereof | 四川瀚洲化工科技有限公司 | 2019-03-05 | — | — | CN | disclosed |
| CN-109385204-A | A kind of water-soluble polyester acid imide insulated paint and preparation method thereof | 湖北长海新能源科技有限公司 | 2019-02-26 | — | — | CN | disclosed |
| CN-109320706-A | A kind of cation dyeable copolyester and its preparation method and application | 东丽纤维研究所（中国）有限公司 | 2019-02-12 | — | — | CN | disclosed |
| CN-109180923-A | A kind of high fluidity resistant easy-to-dye polyester master batch and preparation method thereof | 东华大学 | 2019-01-11 | — | — | CN | disclosed |
| CN-208356768-U | A kind of 5-sodium sulfo isophthalate production automatically cleaning reaction kettle | 焦作润扬化工科技有限公司 | 2019-01-11 | — | — | CN | disclosed |
| CN-108299248-A | A method of it extracting three monomers from three monomer process waste water and purity is higher than 95% sodium sulphate | 泰山医学院 | 2018-07-20 | — | — | CN | disclosed |
| CN-108250106-A | A kind of method for preparing Sodium Dimethyl Isophthalate-5-sulfonate, sodium sulphate by three monomer process waste water | 泰山医学院 | 2018-07-06 | — | — | CN | disclosed |
| CN-108164442-A | A kind of method that three monomers, sodium sulphate and pure water are extracted from three monomer process waste water | 青岛中科荣达新材料有限公司 | 2018-06-15 | — | — | CN | disclosed |
| CN-105503664-B | Method for comprehensively utilizing wastewater of three-monomer production process | 潍坊沃尔特科技有限公司 | 2018-03-23 | — | — | CN | disclosed |
| CN-106488845-A | The multiple-layer laminated film of uniaxial tension and comprise its opticses | 帝人株式会社 | 2017-03-08 | — | — | CN | disclosed |
| CN-104583330-B | Thermoplastic resin composition, resin molded article, and method for producing resin molded article with plating layer | 三菱工程塑料株式会社 | 2016-09-21 | — | — | CN | disclosed |