Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | ALDH3A1 | P30838 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | SMYD2 | Q9NRG4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5819895 | 0.90 | CA1 (0.55) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5819897 | 0.90 | CA1 (0.55) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5820102 | 0.83 | ALDH3A1 (0.58) | CA1CA2ALDH3A1ALDH1A1DRD2 | |
| SCHEMBL5820103 | 0.83 | ALDH3A1 (0.58) | CA1CA2ALDH3A1ALDH1A1DRD2 | |
| SCHEMBL5822089 | 0.81 | CA1 (0.34) | CA1CA2ALDH3A1ALDH1A1BDKRB1 | |
| SCHEMBL5821730 | 0.80 | ALDH1A1 (0.44) | CA1CA2ALDH3A1ALDH1A1HRH3 | |
| SCHEMBL5821742 | 0.78 | CA1 (0.41) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5821740 | 0.78 | CA1 (0.41) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5472944 | 0.73 | KDR (0.61) | CA1CA2ALDH3A1ALDH1A1BCHE | |
| SCHEMBL5472939 | 0.73 | KDR (0.61) | CA1CA2ALDH3A1ALDH1A1BCHE |
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-2006105795-A1 | NOVEL INDOLINONE DERIVATIVES | LEO PHARMA A/S (DK) | 2006-10-12 | — | — | WO | disclosed |