Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.30 |
| ▸ | CDK2 | P24941 | 1/20 | 0.30 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.30 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.30 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.30 |
| ▸ | CDK5R1 | Q15078 | 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 | |
|---|---|---|---|---|
| SCHEMBL5769993 | 0.81 | GABRA1 (0.39) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL5770463 | 0.81 | ALDH1A1 (0.36) | NPC1RAB9ADYRK1A | |
| SCHEMBL5768555 | 0.78 | GABRA1 (0.33) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL5771081 | 0.77 | KDM4E (0.34) | NPC1RAB9AGABRA1GABRG2GABRB3 | |
| SCHEMBL5770695 | 0.74 | JAK2 (0.36) | — | |
| SCHEMBL6217363 | 0.73 | PLCG1 (0.38) | NPC1RAB9A | |
| SCHEMBL5771074 | 0.70 | CCR1 (0.38) | NPC1RAB9ADYRK1A | |
| SCHEMBL22726577 | 0.68 | SSTR4 (0.46) | CDK2 | |
| SCHEMBL6102107 | 0.67 | ALDH1A1 (0.39) | NPC1RAB9ADYRK1A | |
| SCHEMBL5808966 | 0.67 | RAB9A (0.39) | NPC1RAB9ADYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1381606-B1 | IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME (GB) | 2005-07-20 | — | — | EP | disclosed |