Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 10/20 | 0.69 |
| ▸ | CA2 | P00918 | 8/20 | 0.69 |
| ▸ | CA1 | P00915 | 5/20 | 0.69 |
| ▸ | CA9 | Q16790 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | GFER | P55789 | 1/20 | 0.60 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL1220588 | 0.85 | CA4 (0.65) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL7536254 | 0.83 | CA4 (0.66) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL1220443 | 0.83 | CA4 (0.65) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL14980286 | 0.82 | CA4 (0.65) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL1219306 | 0.81 | CA4 (0.67) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL13828097 | 0.79 | CA4 (0.61) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL408184 | 0.79 | CA4 (0.61) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL21172119 | 0.79 | CA4 (0.61) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL13848537 | 0.78 | CA4 (0.49) | CA4CA2CA1CA9ALDH1A1 | |
| SCHEMBL19117746 | 0.76 | CA4 (0.56) | CA4CA2CA1CA9ALDH1A1 |
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-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| US-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |