Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7480517 | 0.82 | PARP1 (0.50) | HRH2HRH3KDM4EALDH1A1HPGD | |
| SCHEMBL7482126 | 0.73 | TDP1 (0.39) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL7482186 | 0.71 | KDM4E (0.36) | KDM4EALDH1A1HPGDSMN1; SMN2GAA | |
| SCHEMBL31617333 | 0.65 | HSD17B10 (0.45) | KDM4EALDH1A1HPGDSMN1; SMN2TSHR | |
| SCHEMBL16200061 | 0.65 | DYRK1A (0.44) | KDM4EALDH1A1HPGDBRD4SMN1; SMN2 | |
| SCHEMBL21818427 | 0.65 | GAA (0.42) | HRH2HRH3KDM4EALDH1A1GAA | |
| SCHEMBL21818430 | 0.65 | GAA (0.42) | HRH2HRH3KDM4EALDH1A1GAA | |
| SCHEMBL15331518 | 0.64 | ALDH1A1 (0.43) | KDM4EALDH1A1HPGDBRD4SMN1; SMN2 | |
| SCHEMBL15331791 | 0.64 | CYP1A2 (0.46) | KDM4EALDH1A1HPGDBRD4SMN1; SMN2 | |
| SCHEMBL15730718 | 0.64 | POLQ (0.33) | BRD4 |
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 |