Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.87 |
| ▸ | PRKDC | P78527 | 2/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.63 |
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | HPGD | P15428 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | ERN1 | O75460 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.43 |
| ▸ | PRNP | P04156 | 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 | |
|---|---|---|---|---|
| SCHEMBL1620382 | 1.00 | LMNA (0.87) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL515642 | 0.88 | PRKDC (1.00) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL23783245 | 0.87 | LMNA (0.70) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL17529474 | 0.86 | PRKDC (0.70) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL29976495 | 0.85 | PRKDC (0.74) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL25692518 | 0.85 | PRKDC (0.74) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL2761533 | 0.84 | ALDH1A1 (0.74) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL31081096 | 0.84 | PRKDC (0.62) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL19640177 | 0.84 | PRKDC (0.72) | LMNAPRKDCALDH1A1MAPTPOLB | |
| SCHEMBL19640183 | 0.83 | PRKDC (0.70) | LMNAPRKDCALDH1A1MAPTPOLB |
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-2576514-A1 | SUBSTITUTED ISOQUINOLINES AND THEIR USE AS TUBULIN POLYMERIZATION INHIBITORS | EXONHIT SA (FR) | 2013-04-10 | — | — | EP | disclosed |
| WO-2011151423-A1 | SUBSTITUTED ISOQUINOLINES AND THEIR USE AS TUBULIN POLYMERIZATION INHIBITORS | EXONHIT S.A. (FR) | 2011-12-08 | — | — | WO | disclosed |