Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | ALPL | P05186 | 2/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| SCHEMBL7482943 | 0.80 | HSP90AA1 (0.39) | — | |
| SCHEMBL7482822 | 0.80 | ROCK2 (0.36) | CYP17A1ALPLLRRK2 | |
| SCHEMBL7486143 | 0.77 | LRRK2 (0.39) | ALPLLRRK2 | |
| SCHEMBL7480513 | 0.76 | ATM (0.41) | ALPL | |
| SCHEMBL7487230 | 0.76 | PARP1 (0.33) | — | |
| SCHEMBL7487084 | 0.74 | HTR7 (0.41) | ALPL | |
| SCHEMBL7486190 | 0.72 | POLL (0.39) | ALPL | |
| SCHEMBL7484067 | 0.68 | GAA (0.50) | ALPL | |
| SCHEMBL7485922 | 0.64 | PARP1 (0.50) | ALPL | |
| SCHEMBL7481495 | 0.64 | POLQ (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177185-A1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.p.A. (IT) | 2002-02-06 | — | — | EP | disclosed |
| WO-2000069846-A1 | 4,5,6,7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA & UPJOHN S.P.A. (IT) | 2000-11-23 | — | — | WO | disclosed |