Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | DNMT1 | P26358 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8185306 | 0.83 | SMN1; SMN2 (0.42) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL8188894 | 0.82 | POLB (0.58) | ALDH1A1KDM4ETP53GLAPOLB | |
| SCHEMBL10166834 | 0.81 | ALDH1A1 (0.44) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL10166837 | 0.79 | ALDH1A1 (0.42) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL3484796 | 0.79 | ALDH1A1 (0.42) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL2194904 | 0.78 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL11964978 | 0.77 | SMN1; SMN2 (0.36) | SMN1; SMN2ALDH1A1KDM4ETP53GLA | |
| SCHEMBL10166842 | 0.75 | MAPT (0.36) | SMN1; SMN2ALDH1A1KDM4ETP53CYP3A4 | |
| SCHEMBL14342669 | 0.75 | MAPT (0.36) | SMN1; SMN2ALDH1A1KDM4ETP53CYP3A4 | |
| SCHEMBL17643692 | 0.74 | MAPT (0.57) | SMN1; SMN2ALDH1A1KDM4ETP53GLA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000044731-A1 | NOVEL HYDROXYAMIDINO CARBOXYLATE DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | G.D. SEARLE & CO. (US) | 2000-08-03 | — | — | WO | disclosed |