Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | CHIT1 | Q13231 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6711052 | 0.79 | TDP1 (0.39) | HRH3CHIT1 | |
| SCHEMBL2116076 | 0.76 | TDP1 (0.44) | LTA4HCHIT1 | |
| SCHEMBL3738377 | 0.73 | TDP1 (0.41) | CHIT1 | |
| SCHEMBL5695790 | 0.71 | TDP1 (0.45) | CHIT1 | |
| SCHEMBL5695792 | 0.71 | TDP1 (0.47) | CHIT1 | |
| SCHEMBL28475644 | 0.70 | SLC6A2 (0.47) | CHIT1 | |
| SCHEMBL28861068 | 0.70 | SLC6A2 (0.47) | CHIT1 | |
| SCHEMBL7950557 | 0.70 | TDP1 (0.41) | HRH3CHIT1 | |
| SCHEMBL6711048 | 0.70 | CHIT1 (0.36) | CHIT1 | |
| SCHEMBL4318962 | 0.70 | LTA4H (0.78) | HRH3LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997044329-A9 | DIARYLALKYL CYCLIC DIAMINE DERIVATIVES AS CHEMOKINE RECEPTOR ANTAGONISTS | — | 1998-03-12 | — | — | WO | disclosed |