Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 6/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | MEN1 | O00255 | 4/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | TTR | P02766 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Trinitrotoluene SCHEMBL891182 | 0.95 | ALDH1A1 (0.61) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL20676 | 0.95 | ALDH1A1 (0.61) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL6280179 | 0.93 | GPR35 (0.60) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL9101080 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL9101074 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL2566651 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL14966503 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL28861138 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL1272395 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 | |
| Trinitrotoluene SCHEMBL14966251 | 0.93 | ALDH1A1 (0.59) | GPR35ALDH1A1KMT2AMEN1TDP1 |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108827941-B | Method for rapidly detecting TNT in water based on surface enhanced Raman spectroscopy | 启东科赛尔纳米科技有限公司 | 2021-06-18 | — | — | CN | claimed |
| CN-108827941-A | A method of quickly detecting TNT in water based on Surface enhanced Raman spectroscopy | 厦门斯贝克科技有限责任公司 | 2018-11-16 | — | — | CN | claimed |
| CN-116332946-B | Application of tetra (methoxy) anthracene group-containing glycoluril molecular clamp crystal material in TNT recovery | 西安近代化学研究所 | 2024-01-02 | — | — | CN | disclosed |
| CN-114656409-B | Fluorescent material for rapidly detecting explosives, preparation method and application thereof | 山东产研绿色与健康研究院有限公司 | 2023-12-22 | — | — | CN | disclosed |
| CN-116332946-A | Application of tetra (methoxy) anthracene group-containing glycoluril molecular clamp crystal material in TNT recovery | 西安近代化学研究所 | 2023-06-27 | — | — | CN | disclosed |
| CN-114656409-A | Fluorescent material for rapidly detecting explosives and preparation method and application thereof | 山东产研绿色与健康研究院有限公司 | 2022-06-24 | — | — | CN | disclosed |
| CN-114527104-A | Dual-mode fluorescent copper nanocluster for rapid fluorescence detection of trinitrotoluene or trinitrophenol | 中国科学院新疆理化技术研究所 | 2022-05-24 | — | — | CN | disclosed |
| CN-108827941-B | Method for rapidly detecting TNT in water based on surface enhanced Raman spectroscopy | 启东科赛尔纳米科技有限公司 | 2021-06-18 | — | — | CN | disclosed |
| CN-110687081-A | Sensor, preparation method and application thereof, and detection method of 2,4, 6-trinitrophenol | 北威(重庆)科技股份有限公司 | 2020-01-14 | — | — | CN | disclosed |
| CN-108827941-A | A method of quickly detecting TNT in water based on Surface enhanced Raman spectroscopy | 厦门斯贝克科技有限责任公司 | 2018-11-16 | — | — | CN | disclosed |
| CN-105254853-B | Water-dispersible hyperbranched conjugated polymer fluorescent nanoparticles as well as preparation method and application thereof | 中国科学院长春应用化学研究所 | 2017-04-26 | — | — | CN | disclosed |
| CN-105254853-A | Water-dispersible hyperbranched conjugated polymer fluorescent nanoparticles as well as preparation method and application thereof | CHANGCHUN APPLIED CHEMISTRY | 2016-01-20 | — | — | CN | disclosed |
| CN-104849258-A | Flexible erasable SERS (surface-enhanced Raman scattering) active substrate and preparation method thereof | UNIV CHENGDU | 2015-08-19 | — | — | CN | disclosed |
| CN-102183503-A | Light irradiation preparation method and use of ultra-sensitive surface enhanced Raman scattering active base | HEFEI INST PHYSICAL SCI CAS | 2011-09-14 | — | — | CN | disclosed |
| CN-101597372-B | Fluorescent conjugated polymer silicon oxide nanoparticle preparation method and application thereof | UNIV ZHEJIANG | 2011-01-05 | — | — | CN | disclosed |
| CN-101597372-A | The preparation method and its usage of fluorescent conjugated polymer silicon oxide nanoparticle | UNIV ZHEJIANG (CN) | 2009-12-09 | — | — | CN | disclosed |