Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | PRKDC | P78527 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22362588 | 0.82 | ALDH1A1 (0.44) | ALDH1A1PRKDCIKBKBMAPK9MAPK10 | |
| SCHEMBL27883229 | 0.82 | MAPT (0.46) | ALDH1A1PRKDCIKBKBMAPK9MAPK10 | |
| SCHEMBL828076 | 0.82 | ALDH1A1 (0.48) | ALDH1A1PRKDCIKBKBMAPK9MAPK10 | |
| SCHEMBL27883269 | 0.81 | MAPT (0.52) | ALDH1A1KDM4EHTTHPGDPKM | |
| SCHEMBL827916 | 0.77 | ALDH1A1 (0.48) | ALDH1A1PRKDCIKBKBMAPK9MAPK10 | |
| SCHEMBL17979907 | 0.76 | ALDH1A1 (0.58) | ALDH1A1MAPK9MAPK10KDM4EHTT | |
| SCHEMBL11150985 | 0.76 | PRKDC (0.46) | ALDH1A1PRKDCKDM4EHTTHPGD | |
| SCHEMBL7141105 | 0.73 | ALDH1A1 (0.38) | ALDH1A1MAPK9MAPK10ABCC1MAPT | |
| SCHEMBL3230406 | 0.73 | PRKDC (0.58) | ALDH1A1PRKDCKDM4EHTTHPGD | |
| SCHEMBL3228970 | 0.73 | MAPT (0.56) | ALDH1A1PRKDCKDM4EHTTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-8143274-B2 | 1-(2H)-isoquinolone derivative | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2012-03-27 | — | — | US | disclosed |