Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | FBP1 | P09467 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Anisole SCHEMBL28098758 | 0.90 | CA4 (0.52) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL3183985 | 0.79 | TDP1 (0.48) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL27619321 | 0.79 | HSPB1 (0.55) | ALDH1A1LMNAPOLBCA12CA1 | |
| SCHEMBL4235340 | 0.79 | MEN1 (0.43) | SMN1; SMN2NPC1RAB9AKMT2ALMNA | |
| SCHEMBL3889092 | 0.78 | KCNA3 (0.46) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL4511614 | 0.76 | MEN1 (0.43) | KMT2AALDH1A1CA12CA1CA2 | |
| SCHEMBL7465418 | 0.76 | HDAC1 (0.46) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL4282626 | 0.75 | NPC1 (0.33) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL9323722 | 0.75 | IDO1 (0.48) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL8957335 | 0.75 | SMN1; SMN2 (0.58) | SMN1; SMN2NPC1RAB9AKMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5977418-A | Regioselective nitration of aromatic compounds by dinitrogen pentoxide and the reaction products thereof | DAMAVARAPU REDDY (US) | 1999-11-02 | — | — | US | claimed |
| US-5946638-A | Regioselective nitration of aromatic compounds and the reaction products thereof | GOVERNMENT OF THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETRY OF THE ARMY | 1999-08-31 | — | — | US | claimed |