Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 7/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4329036 | 0.87 | NPC1 (0.43) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL4329337 | 0.84 | NPC1 (0.44) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL5479876 | 0.82 | NPC1 (0.42) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL5491712 | 0.81 | NPC1 (0.41) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL4330936 | 0.81 | PSEN1 (0.45) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL5483579 | 0.81 | NPC1 (0.41) | NPC1RAB9ATP53THRBMAPT | |
| SCHEMBL5478271 | 0.77 | GRM5 (0.52) | NPC1RAB9ATP53THRBMEN1 | |
| SCHEMBL5478173 | 0.76 | PSEN1 (0.39) | NPC1RAB9ATP53THRBMAPT | |
| SCHEMBL5485017 | 0.76 | NPC1 (0.38) | NPC1RAB9ATP53THRBMAPT | |
| SCHEMBL4234513 | 0.72 | KDR (0.38) | NPC1RAB9ATP53MAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7576077-B2 | Fused heterocyclic compounds and their use as metabotropic glutamate receptor antagonists | ASTRAZENECA AB (SE) | 2009-08-18 | — | — | US | claimed |