Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.69 |
| ▸ | RAB9A | P51151 | 1/20 | 0.69 |
| ▸ | GABRP | O00591 | 4/20 | 0.66 |
| ▸ | GABRD | O14764 | 4/20 | 0.66 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.66 |
| ▸ | GABRB1 | P18505 | 4/20 | 0.66 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.66 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.66 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.66 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.66 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.66 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.66 |
| ▸ | GABRA4 | P48169 | 4/20 | 0.66 |
| ▸ | GABRE | P78334 | 4/20 | 0.66 |
| ▸ | GABRA6 | Q16445 | 4/20 | 0.66 |
| ▸ | GABRG1 | Q8N1C3 | 4/20 | 0.66 |
| ▸ | GABRG3 | Q99928 | 4/20 | 0.66 |
| ▸ | GABRQ | Q9UN88 | 4/20 | 0.66 |
| ▸ | POLB | P06746 | 2/20 | 0.66 |
| ▸ | IGF1R | P08069 | 2/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL7719104 | 0.85 | NPC1 (0.67) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL4760802 | 0.82 | RAB9A (1.00) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL13896412 | 0.80 | GABRP (1.00) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL30712063 | 0.79 | NPC1 (0.71) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL31060147 | 0.77 | POLB (0.73) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL4758953 | 0.77 | CDK4 (0.58) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL30712070 | 0.76 | GABRP (0.72) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL20271620 | 0.76 | POLB (0.60) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL3123492 | 0.75 | GABRP (0.74) | NPC1RAB9AGABRPGABRDGABRA1 | |
| SCHEMBL1129545 | 0.75 | POLB (0.70) | NPC1RAB9AGABRPGABRDGABRA1 |
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-0975584-B1 | SYNTHESIS AND USE OF ALPHA-KETOAMIDE DERIVATIVES AND ARRAYS | ARQULE INC (US) | 2002-09-25 | — | — | EP | claimed |