Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.69 |
| ▸ | TSHR | P16473 | 2/20 | 0.63 |
| ▸ | HPGD | P15428 | 2/20 | 0.63 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 4/20 | 0.59 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | DHODH | Q02127 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.57 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2213195 | 0.85 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL53323 | 0.82 | ALDH1A1 (1.00) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL20990440 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL606143 | 0.82 | ALDH1A1 (1.00) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL3729153 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL14414533 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL659023 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL4003611 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL4009579 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL7932159 | 0.82 | ALDH1A1 (0.74) | ALDH1A1TSHRHPGDMEN1KMT2A |
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-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |