Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.30 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.30 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.30 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11046564 | 0.96 | TDP1 (0.34) | TDP1ALDH1A1TSHR | |
| SCHEMBL11040250 | 0.89 | TDP1 (0.35) | TDP1ALDH1A1TSHR | |
| SCHEMBL11517162 | 0.85 | ALDH1A1 (0.32) | TDP1ALDH1A1TSHR | |
| SCHEMBL29094191 | 0.83 | ALDH1A1 (0.33) | TDP1ALDH1A1TSHR | |
| SCHEMBL15957606 | 0.80 | TDP1 (0.50) | TDP1ALDH1A1TSHRPKMGRIN2D | |
| SCHEMBL8975921 | 0.78 | ALDH1A1 (0.31) | TDP1ALDH1A1TSHR | |
| SCHEMBL11041007 | 0.77 | TDP1 (0.48) | TDP1ALDH1A1TSHRPKMGRIN2D | |
| SCHEMBL4927428 | 0.74 | TDP1 (0.50) | TDP1ALDH1A1TSHRPKMGRIN2D | |
| SCHEMBL8091014 | 0.72 | TDP1 (0.44) | TDP1ALDH1A1TSHRMAPTL3MBTL1 | |
| SCHEMBL11044607 | 0.72 | TSHR (0.42) | TDP1ALDH1A1TSHRPKMMAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4451681-A | Methods of preparing pentanitrotoluene | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1984-05-29 | — | — | US | claimed |
| US-4426539-A | Synthesis of the isomeric aminotetranitrotoluenes | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1984-01-17 | — | — | US | claimed |
| US-4451681-A | Methods of preparing pentanitrotoluene | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1984-05-29 | — | — | US | disclosed |
| US-4426539-A | Synthesis of the isomeric aminotetranitrotoluenes | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1984-01-17 | — | — | US | disclosed |
| US-4426539-A | Synthesis of the isomeric aminotetranitrotoluenes | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 1984-01-17 | — | — | US | disclosed |