Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.81 |
| ▸ | MAPT | P10636 | 3/20 | 0.81 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.76 |
| ▸ | RAB9A | P51151 | 5/20 | 0.70 |
| ▸ | HPGD | P15428 | 3/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.70 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | ATM | Q13315 | 1/20 | 0.58 |
| ▸ | SCN1A | P35498 | 1/20 | 0.58 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.58 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9706 | 0.98 | MAPT (0.85) | GAAMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL11334339 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL27806510 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL11341322 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| Hydrochloric Acid SCHEMBL3308284 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| Hydrochloric Acid SCHEMBL29096649 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| Water SCHEMBL27398863 | 0.96 | GAA (0.81) | GAAMAPTALDH1A1RAB9AHPGD | |
| Propionic Acid SCHEMBL11512001 | 0.94 | GAA (0.79) | GAAMAPTALDH1A1RAB9AHPGD | |
| Acetic Acid SCHEMBL28138148 | 0.94 | MAPT (0.79) | GAAMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL9478708 | 0.90 | MAPT (1.00) | GAAMAPTALDH1A1RAB9AHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1022322-C | Fused pyrazole 3-oxo-propionitrile derivatives | ERBA CARLO SPA (IT) | 1993-10-06 | — | — | CN | disclosed |
| CN-1038642-A | The preparation method of condensed pyrazole 3-oxo-propanenitrile derivatives | ERBA CARLO SPA (IT) | 1990-01-10 | — | — | CN | disclosed |
| US-4252977-A | Novel acetamide compounds and process for producing them | GENERAL ELECTRIC COMPANY (US) | 1981-02-24 | — | — | US | disclosed |