Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFD | P00746 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | IKBKB | O14920 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 4/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8220657 | 0.77 | EPHX1 (0.46) | CFDKDM4EALDH1A1GSK3BGAA | |
| SCHEMBL12000436 | 0.77 | EPHX1 (0.46) | CFDKDM4EALDH1A1GSK3BGAA | |
| SCHEMBL6470700 | 0.76 | IKBKB (0.36) | KDM4EALDH1A1IKBKBGAA | |
| SCHEMBL5274230 | 0.76 | HPGD (0.49) | ALDH1A1GSK3BGAAROCK2HDAC1 | |
| SCHEMBL5274499 | 0.75 | KMT2A (0.46) | KDM4EALDH1A1GAAPOLBHTT | |
| SCHEMBL5267185 | 0.73 | POLB (0.48) | KDM4EALDH1A1GAAPOLBROCK2 | |
| SCHEMBL13816854 | 0.73 | ALDH1A1 (0.50) | KDM4EALDH1A1GAAPOLB | |
| SCHEMBL1709275 | 0.73 | CFD (0.57) | CFDKDM4EALDH1A1GSK3BGAA | |
| SCHEMBL5269714 | 0.73 | ROCK2 (0.54) | GSK3BROCK2HDAC1HDAC6ROCK1 | |
| SCHEMBL5270571 | 0.73 | KMT2A (0.59) | ALDH1A1GAAPOLBHTT |
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-2008007113-A2 | PHARMACEUTICAL COMBINATIONS | ASTEX THERAPEUTICS LIMITED (GB) | 2008-01-17 | — | — | WO | disclosed |