Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CTSD | P07339 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10192631 | 0.83 | ALDH1A1 (0.58) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL27797486 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL8113842 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL332011 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL17144681 | 0.81 | ALDH1A1 (0.56) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL6655749 | 0.80 | ALDH1A1 (0.53) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL528555 | 0.80 | ALDH1A1 (0.58) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL20916593 | 0.80 | ALDH1A1 (0.55) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL27431445 | 0.80 | ALDH1A1 (0.55) | ALDH1A1MAPTMAPK1KDM4EPKM | |
| SCHEMBL11048095 | 0.80 | ALDH1A1 (0.55) | ALDH1A1MAPTMAPK1KDM4EPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017013593-A1 | ISOQUINOLINONE DERIVATIVES AS PARP INHIBITORS | LUPIN LIMITED (IN) | 2017-01-26 | — | — | WO | disclosed |
| WO-2017013593-A1 | ISOQUINOLINONE DERIVATIVES AS PARP INHIBITORS | LUPIN LIMITED (IN) | 2017-01-26 | — | — | WO | disclosed |