Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.47 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.42 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 9/20 | 0.41 |
| ▸ | MEN1 | O00255 | 9/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 9/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 7/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7655014 | 0.86 | ALDH1A1 (0.39) | RORCROCK2MAPTMEN1KMT2A | |
| SCHEMBL7993309 | 0.83 | ROCK2 (0.52) | RORCKCNQ3KCNQ2ROCK2MAPT | |
| SCHEMBL7649851 | 0.78 | MAPT (0.49) | ROCK2MAPTMEN1KMT2AHTT | |
| SCHEMBL7654514 | 0.78 | MAPT (0.56) | MAPTMEN1KMT2APOLBHTT | |
| SCHEMBL7656844 | 0.78 | ROCK2 (0.50) | RORCKCNQ3KCNQ2ROCK2MAPT | |
| SCHEMBL7656812 | 0.76 | CYP26A1 (0.38) | RORCROCK2MAPTMEN1KMT2A | |
| SCHEMBL7655629 | 0.76 | ROCK2 (0.50) | RORCKCNQ3KCNQ2ROCK2MAPT | |
| SCHEMBL7656576 | 0.75 | MEN1 (0.40) | MAPTMEN1KMT2ANPC1RAB9A | |
| SCHEMBL7661456 | 0.75 | RORC (0.47) | RORCKCNQ3KCNQ2ROCK2MAPT | |
| SCHEMBL7658184 | 0.74 | RORC (0.49) | RORCKCNQ3KCNQ2ROCK2MAPT |
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-6492378-B1 | Substituted isoquinoline derivatives and their use as anticonvulsivants | SMITHKLINE BEECHAM P.L.C. (GB) | 2002-12-10 | — | — | US | disclosed |