Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL10879900 | 0.82 | TSHR (0.38) | TSHRCHRM2MEN1CYP2C19KMT2A | |
| Propylene Oxide SCHEMBL29238686 | 0.81 | NPC1 (0.41) | ALDH1A1TSHRCYP1A2GRM2SMN1; SMN2 | |
| Toluene SCHEMBL27963582 | 0.81 | ACHE (0.58) | ALDH1A1TSHRSMN1; SMN2MEN1CYP2C19 | |
| Chlorobenzene SCHEMBL29027164 | 0.81 | TSHR (0.58) | ALDH1A1TSHRCYP1A2SLC6A4MEN1 | |
| SCHEMBL15274537 | 0.80 | CHRM2 (0.57) | TSHRCHRM2TAAR1KDM1AMAOB | |
| Phenol SCHEMBL1224881 | 0.79 | CA12 (0.55) | ALDH1A1TSHRMEN1CYP2C19KMT2A | |
| Aniline SCHEMBL9226304 | 0.79 | TSHR (0.55) | ALDH1A1TSHRCYP1A2MEN1CYP2C19 | |
| Phenol SCHEMBL1738526 | 0.79 | CA12 (0.55) | ALDH1A1TSHRMEN1CYP2C19KMT2A | |
| Benzene SCHEMBL28146919 | 0.78 | TSHR (0.36) | TSHRCHRM2MEN1CYP2C19KMT2A | |
| Biphenyl SCHEMBL28384213 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TSHRMEN1KMT2ATAAR1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104926704-B | Aziridine class compound and preparation method thereof | 浙江九洲药物科技有限公司 | 2019-03-05 | — | — | CN | claimed |
| CN-104926704-A | Nitrogen heterocyclic propane compound and preparation method thereof | ZHEJIANG JIUZHOU PHARMACEUTICAL TECHNOLOGY CO LTD | 2015-09-23 | — | — | CN | claimed |
| CN-109804305-A | Liquid-crystal apparatus and its manufacturing method | JSR株式会社 | 2019-05-24 | — | — | CN | disclosed |
| CN-104926704-B | Aziridine class compound and preparation method thereof | 浙江九洲药物科技有限公司 | 2019-03-05 | — | — | CN | disclosed |
| CN-104926704-B | Aziridine class compound and preparation method thereof | 浙江九洲药物科技有限公司 | 2019-03-05 | — | — | CN | disclosed |
| CN-104926704-A | Nitrogen heterocyclic propane compound and preparation method thereof | ZHEJIANG JIUZHOU PHARMACEUTICAL TECHNOLOGY CO LTD | 2015-09-23 | — | — | CN | disclosed |
| CN-102124063-A | Anticorrosive coating composition and anticorrosive coating film structure using same | SHOWA DENKO KK | 2011-07-13 | — | — | CN | disclosed |
| US-20110135943-A1 | ANTICORROSIVE COATING COMPOSITION AND ANTICORROSIVE COATING STRUCTURE USING SAME | SHOWA DENKO K.K. (JP) | 2011-06-09 | — | — | US | disclosed |