Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 4/20 | 0.33 |
| ▸ | HTR2B | P41595 | 4/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | HTR2A | P28223 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10018676 | 0.91 | CA1 (0.33) | CA1CA2CA12CA9HTR2C | |
| SCHEMBL17350054 | 0.90 | CA1 (0.32) | CA1CA2CA12CA9HTR2C | |
| SCHEMBL17940671 | 0.78 | ALDH1A1 (0.31) | ALDH1A1 | |
| SCHEMBL30391672 | 0.74 | ALDH1A1 (0.39) | CA1CA2CA12CA9KDM1A | |
| SCHEMBL3199027 | 0.74 | ALDH1A1 (0.39) | CA1CA2CA12CA9KDM1A | |
| SCHEMBL18124824 | 0.73 | CA1 (0.39) | CA1CA2CA12CA9 | |
| SCHEMBL4590214 | 0.73 | CA2 (0.39) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL31554010 | 0.73 | CA2 (0.39) | CA1CA2CA12CA9ALDH1A1 | |
| SCHEMBL6693267 | 0.73 | ACHE (0.39) | CA1CA2CA12CA9CYP2A13 | |
| SCHEMBL3179138 | 0.73 | CYP3A4 (0.39) | CA1CA2CA12CA9ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102482572-B | Novel compound for organic electronic material and organic electronic device using the same | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2016-06-01 | — | — | CN | disclosed |
| CN-104478650-A | Novel compounds for organic electronic material and organic electronic device using the same | ROHM & HAAS ELECT MAT | 2015-04-01 | — | — | CN | disclosed |