Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | ADK | P55263 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL16560321 | 0.77 | KDM4E (0.52) | ALDH1A1KDM4EADORA2A | |
| SCHEMBL7419102 | 0.76 | NISCH (0.42) | ALDH1A1KDM4ENISCHMTORADK | |
| SCHEMBL197279 | 0.75 | NISCH (0.54) | ALDH1A1KDM4ENISCHMTORADK | |
| SCHEMBL15259719 | 0.75 | HRH4 (0.47) | ALDH1A1KDM4E | |
| SCHEMBL13830975 | 0.71 | NISCH (0.39) | ALDH1A1NISCHMTORADKMEN1 | |
| SCHEMBL29079328 | 0.69 | NISCH (0.47) | ALDH1A1KDM4ENISCHMTORADK | |
| SCHEMBL20417166 | 0.69 | HRH4 (0.41) | ALDH1A1KDM4E | |
| SCHEMBL24915610 | 0.67 | KDM4E (0.40) | ALDH1A1KDM4E | |
| SCHEMBL17258436 | 0.67 | HRH4 (0.44) | ALDH1A1KDM4E | |
| SCHEMBL14304159 | 0.67 | NISCH (0.46) | ALDH1A1KDM4ENISCHMTORADK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113121502-A | Heteroaromatic hydrocarbon compound, intermediate, composition and application | 山东铂源生物医药有限公司 | 2021-07-16 | — | — | CN | disclosed |