Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | GAA | P10253 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | GLA | P06280 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6218432 | 0.80 | KDM5B (0.33) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6220092 | 0.77 | KDM4E (0.31) | RAB9AKDM4EALDH1A1GAANPC1 | |
| SCHEMBL6218273 | 0.77 | DYRK1A (0.33) | KDM4EALDH1A1GLAHPGDDYRK1A | |
| SCHEMBL7225919 | 0.73 | KDM4E (0.40) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6217345 | 0.71 | — | — | |
| SCHEMBL6222905 | 0.70 | KDM4E (0.43) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6102107 | 0.70 | ALDH1A1 (0.39) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL5771081 | 0.69 | KDM4E (0.34) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6217690 | 0.69 | HPGD (0.41) | SMN1; SMN2RAB9AKDM4EALDH1A1GAA | |
| SCHEMBL6217150 | 0.69 | SMN1; SMN2 (0.33) | SMN1; SMN2RAB9AKDM4EALDH1A1NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1383768-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2006-09-06 | — | — | EP | disclosed |
| EP-1381606-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2005-07-20 | — | — | EP | disclosed |
| US-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |