Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 1.00 |
| ▸ | RECQL | P46063 | 2/20 | 0.67 |
| ▸ | MAPT | P10636 | 10/20 | 0.62 |
| ▸ | RAB9A | P51151 | 5/20 | 0.62 |
| ▸ | LMNA | P02545 | 5/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.62 |
| ▸ | HPGD | P15428 | 3/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.59 |
| ▸ | GAA | P10253 | 4/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1863 | 1.00 | HTT (1.00) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL1862 | 1.00 | HTT (1.00) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL23251385 | 0.86 | MAPT (0.81) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL6997673 | 0.81 | HTT (0.67) | HTTMAPTLMNACYP1A2HPGD | |
| SCHEMBL6997670 | 0.81 | HTT (0.67) | HTTMAPTLMNACYP1A2HPGD | |
| SCHEMBL4269488 | 0.80 | HTT (0.67) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL4269491 | 0.80 | HTT (0.67) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL425338 | 0.80 | RECQL (1.00) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL29176317 | 0.80 | RECQL (1.00) | HTTRECQLMAPTRAB9ALMNA | |
| SCHEMBL446006 | 0.80 | RECQL (1.00) | HTTRECQLMAPTRAB9ALMNA |
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-6509361-B1 | Inhibit the activity of p38 MAP kinase. Also contemplated by the invention are processes for the preparation of the contemplated compounds and for the use of a contemplated compound in treating a mammalian host having a p38 kinase or | PHARMACIA CORPORATION | 2003-01-21 | — | — | US | disclosed |