Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5218299 | 0.85 | MAPT (0.53) | MAPTLMNATP53ITGB1ITGA4 | |
| SCHEMBL5214312 | 0.81 | MAPT (0.50) | MAPTLMNATP53RAB9APOLB | |
| SCHEMBL28769034 | 0.81 | MAPT (0.39) | AOC3MAPTLMNATP53RAB9A | |
| SCHEMBL27714640 | 0.81 | MAPT (0.43) | MAPTLMNATP53RAB9APOLB | |
| SCHEMBL28768848 | 0.81 | MAPT (0.39) | MAPTLMNATP53RAB9APOLB | |
| SCHEMBL27714643 | 0.81 | MAPT (0.43) | AOC3MAPTLMNATP53RAB9A | |
| SCHEMBL27714654 | 0.80 | AVPR1B (0.38) | AOC3MAPTLMNATP53RAB9A | |
| SCHEMBL5215826 | 0.80 | MAPT (0.47) | MAPTLMNATP53ITGB1ITGA4 | |
| SCHEMBL5222457 | 0.79 | RAB9A (0.47) | MAPTLMNATP53RAB9AL3MBTL1 | |
| Trifluoroacetic Acid SCHEMBL5359387 | 0.79 | MAPT (0.50) | MAPTLMNATP53ITGB1ITGA4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101115528-A | Inhibitors of HIV-1 capsid formation: substituted aryl aminomethyl thiazole ureas and analogs thereof | ACHILLION PHARMACEUTICALS INC (US) | 2008-01-30 | — | — | CN | claimed |
| CN-101115528-A | Inhibitors of HIV-1 capsid formation: substituted aryl aminomethyl thiazole ureas and analogs thereof | ACHILLION PHARMACEUTICALS INC (US) | 2008-01-30 | — | — | CN | disclosed |