Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BUB1 | O43683 | 2/20 | 0.32 |
| ▸ | ALPL | P05186 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL31418674 | 0.59 | HCAR2 (0.40) | HCAR2BUB1 | |
| SCHEMBL6164331 | 0.57 | DHODH (0.34) | — | |
| SCHEMBL17987539 | 0.56 | — | — | |
| SCHEMBL25344995 | 0.55 | TP53 (0.36) | — | |
| SCHEMBL8283553 | 0.55 | HCAR2 (0.76) | HCAR2 | |
| SCHEMBL26685314 | 0.54 | SHBG (0.39) | — | |
| SCHEMBL26242998 | 0.53 | HCAR2 (0.42) | HCAR2 | |
| SCHEMBL26251966 | 0.53 | HCAR2 (0.42) | HCAR2 | |
| SCHEMBL26251972 | 0.53 | HCAR2 (0.42) | HCAR2 | |
| SCHEMBL17372084 | 0.52 | NOS3 (0.31) | — |
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 |