Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 4/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7714543 | 0.84 | PIK3CA (0.55) | — | |
| SCHEMBL7714603 | 0.84 | HRH4 (0.57) | HRH4HRH3HTR6KCNH2 | |
| SCHEMBL7714574 | 0.82 | DHFR (0.41) | HRH4 | |
| SCHEMBL7708586 | 0.80 | KDM4E (0.46) | HRH4 | |
| SCHEMBL7708584 | 0.79 | SMO (0.41) | HRH4HTR6 | |
| SCHEMBL7714269 | 0.78 | TSHR (0.49) | — | |
| SCHEMBL4560009 | 0.77 | HRH4 (0.54) | HRH4HRH3HTR6 | |
| SCHEMBL16652723 | 0.74 | TAAR1 (0.64) | TAAR1HTR6 | |
| SCHEMBL16652332 | 0.74 | TAAR1 (0.64) | TAAR1HTR6 | |
| SCHEMBL28065684 | 0.73 | HTR6 (0.53) | TAAR1HTR6 |
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-102118969-B | Diaminopyridine, diaminopyrimidine and diaminopyridazine modulators of the histamine H4 receptor | 詹森药业有限公司 | 2017-03-08 | — | — | CN | claimed |
| CN-102118969-B | Diaminopyridine, diaminopyrimidine and diaminopyridazine modulators of the histamine H4 receptor | 詹森药业有限公司 | 2017-03-08 | — | — | CN | disclosed |