Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABAT | P80404 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 10/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 12/20 | 0.40 |
| ▸ | MEN1 | O00255 | 11/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 11/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 6/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.40 |
| ▸ | HTT | P42858 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 4/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4629898 | 0.91 | GAA (0.45) | MAPTNPC1GAAMEN1KMT2A | |
| SCHEMBL197214 | 0.91 | GAA (0.45) | MAPTNPC1GAAMEN1KMT2A | |
| Thiophene SCHEMBL10901363 | 0.85 | GAA (0.41) | MAPTNPC1GAAMEN1KMT2A | |
| Formamide SCHEMBL11498345 | 0.85 | GAA (0.41) | ABATMAPTNPC1GAAMEN1 | |
| Benzene SCHEMBL27714747 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 | |
| Hydrochloric Acid SCHEMBL3069393 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 | |
| SCHEMBL1330698 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 | |
| SCHEMBL41828 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 | |
| SCHEMBL7785939 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 | |
| Hydrochloric Acid SCHEMBL2006870 | 0.82 | ABAT (0.53) | ABATMAPTNPC1GAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0923287-A4 | NONCLASSICAL PYRROLO 2,3-D]PYRIMIDINE ANTIFOLATES | LILLY CO ELI (US) | 2001-08-01 | — | — | EP | disclosed |
| EP-0923287-A1 | NONCLASSICAL PYRROLO 2,3-D]PYRIMIDINE ANTIFOLATES | ELI LILLY AND COMPANY (US) | 1999-06-23 | — | — | EP | disclosed |
| WO-1998008382-A1 | NONCLASSICAL PYRROLO[2,3-D]PYRIMIDINE ANTIFOLATES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |