Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K11 | Q16584 | 9/20 | 0.60 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | KIT | P10721 | 4/20 | 0.45 |
| ▸ | PRKCQ | Q04759 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2527600 | 0.89 | MAP3K11 (0.73) | MAP3K11LRRK2MEN1NPC1HCRTR1 | |
| SCHEMBL724259 | 0.86 | MAP3K11 (0.83) | MAP3K11LRRK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2522333 | 0.78 | MAP3K11 (0.80) | MAP3K11LRRK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2523833 | 0.78 | MAP3K11 (0.72) | MAP3K11CYP3A4CYP2D6ALDH1A1TSHR | |
| SCHEMBL27841169 | 0.77 | MAP3K11 (0.83) | MAP3K11LRRK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL722601 | 0.77 | MAP3K11 (0.58) | MAP3K11LRRK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2526465 | 0.77 | NPC1 (0.71) | MAP3K11LRRK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2531824 | 0.76 | MAP3K11 (0.56) | MAP3K11LRRK2CYP3A4KITIGF1R | |
| SCHEMBL720862 | 0.75 | MAP3K11 (1.00) | MAP3K11LRRK2CYP3A4CYP2D6KIT | |
| SCHEMBL4339872 | 0.74 | MAP3K11 (0.63) | MAP3K11LRRK2MEN1NPC1HCRTR1 |
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-2379561-A2 | MLK INHIBITORS AND METHODS OF USE | University Of Rochester (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010068483-A2 | MLK INHIBITORS AND METHODS OF USE | UNIVERSITY OF ROCHESTER (US) | 2010-06-17 | — | — | WO | disclosed |