Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL11212898 | 0.86 | NPC1 (0.54) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL30301304 | 0.86 | NPC1 (0.54) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL7079525 | 0.83 | L3MBTL1 (0.51) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| SCHEMBL28711796 | 0.83 | TDP1 (0.44) | NPC1RAB9AKDM4ETDP1L3MBTL1 | |
| Iodide SCHEMBL7734358 | 0.78 | MAOA (0.51) | NPC1RAB9AKDM4EGAAL3MBTL1 | |
| Iodide SCHEMBL7734353 | 0.78 | MAOA (0.51) | NPC1RAB9AKDM4EGAAL3MBTL1 | |
| SCHEMBL8521451 | 0.75 | KDM4E (0.50) | NPC1RAB9AKDM4ETSHRGAA | |
| SCHEMBL10945083 | 0.74 | HRH1 (0.45) | TDP1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL17607340 | 0.74 | HRH1 (0.45) | TDP1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL29804851 | 0.73 | MAOB (0.54) | GAAMEN1KMT2AMAPT |
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-2349999-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | Universität des Saarlandes (DE) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010043711-A1 | ALLOSTERIC PROTEIN KINASE MODULATORS | UNIVERSITAET DES SAARLANDES (DE) | 2010-04-22 | — | — | WO | disclosed |