Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.53 |
| ▸ | RAB9A | P51151 | 8/20 | 0.53 |
| ▸ | TP53 | P04637 | 8/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.51 |
| ▸ | PKM | P14618 | 4/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.50 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.49 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.46 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10532301 | 0.80 | NPC1 (0.55) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL13745560 | 0.80 | F2RL3 (0.46) | NPC1RAB9ATP53PDE10APDCD1 | |
| SCHEMBL13750723 | 0.79 | RAB9A (0.54) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL12844138 | 0.78 | PDE10A (0.36) | NPC1RAB9APDE10APDCD1CD274 | |
| SCHEMBL10768986 | 0.78 | NPC1 (0.50) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL2067920 | 0.77 | PDE10A (0.34) | NPC1RAB9APDE10APDCD1CD274 | |
| SCHEMBL13080159 | 0.77 | PDCD1 (0.36) | NPC1RAB9APDE10APDCD1CD274 | |
| SCHEMBL2954578 | 0.76 | NPC1 (0.60) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL3108835 | 0.76 | NPC1 (0.54) | NPC1RAB9ATP53SMN1; SMN2PKM | |
| SCHEMBL14076027 | 0.76 | NPC1 (0.54) | NPC1RAB9ATP53SMN1; SMN2PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009095377-A1 | SPIRO COMPOUNDS AS NPY Y5 RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-08-06 | — | — | WO | disclosed |