Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.53 |
| ▸ | CA12 | O43570 | 4/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | CA7 | P43166 | 4/20 | 0.50 |
| ▸ | CA9 | Q16790 | 4/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL14385490 | 0.88 | NR1H2 (0.61) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL1296287 | 0.88 | CYP3A4 (0.56) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL11217952 | 0.86 | NR1H2 (0.50) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL11242090 | 0.79 | KDM4E (0.46) | SMN1; SMN2NR1H2NR1H3CA12CA1 | |
| SCHEMBL11583108 | 0.79 | KDM4E (0.56) | CYP3A4SMN1; SMN2HPGDCA12CA1 | |
| SCHEMBL1626377 | 0.79 | NR1H2 (0.62) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL29812142 | 0.79 | NR1H2 (0.62) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL348414 | 0.77 | NR1H2 (0.61) | CYP3A4SMN1; SMN2TDP1NR1H2NR1H3 | |
| SCHEMBL3794437 | 0.77 | CYP3A4 (0.40) | CYP3A4SMN1; SMN2HPGDALDH1A1KDM4E | |
| SCHEMBL10864783 | 0.77 | ALDH1A1 (0.50) | CYP3A4SMN1; SMN2TDP1HPGDALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4079052-A | Diazopigments containing pyridine derivatives | CIBA-GEIGY CORPORATION (US) | 1978-03-14 | — | — | US | disclosed |