Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.45 |
| ▸ | MECP2 | P51608 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 9/20 | 0.43 |
| ▸ | RAB9A | P51151 | 8/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22347233 | 0.84 | NPC1 (0.50) | NOTUMMECP2NPC1RAB9AALDH1A1 | |
| SCHEMBL1544834 | 0.83 | NPC1 (0.55) | NOTUMNPC1RAB9AALDH1A1MAPT | |
| SCHEMBL514236 | 0.83 | RAB9A (0.57) | NOTUMNPC1RAB9AALDH1A1MAPT | |
| SCHEMBL1544194 | 0.83 | NPC1 (0.54) | NOTUMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL6216439 | 0.83 | NPC1 (0.55) | NOTUMNPC1RAB9AALDH1A1MAPT | |
| SCHEMBL1544190 | 0.81 | NOTUM (0.45) | NOTUMNPC1RAB9AALDH1A1MAPT | |
| SCHEMBL1543938 | 0.81 | TP53 (0.56) | NOTUMNPC1RAB9AALDH1A1MAPT | |
| SCHEMBL22347945 | 0.81 | NR1H4 (0.45) | NOTUMMECP2NPC1RAB9AALDH1A1 | |
| SCHEMBL29614707 | 0.81 | NR1H4 (0.45) | NOTUMMECP2NPC1RAB9AALDH1A1 | |
| SCHEMBL120396 | 0.80 | NOTUM (0.68) | NOTUMNPC1RAB9AALDH1A1MAPT |
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-2007130824-A2 | FUSED HETEROCYLIC COMPOUNDS AND THEIR USE AS MGLUR5 MODULATORS | ASTRAZENECA AB (SE) | 2007-11-15 | — | — | WO | disclosed |