Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.49 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL12366135 | 0.83 | LMNA (0.62) | KMT2AALDH1A1HPGDNPC1RAB9A | |
| SCHEMBL12366096 | 0.83 | L3MBTL1 (0.57) | KMT2AMEN1ALDH1A1HPGDGAA | |
| SCHEMBL12366188 | 0.83 | LMNA (0.47) | KMT2AALDH1A1HPGDPOLBCA12 | |
| SCHEMBL12366100 | 0.83 | ALDH1A1 (0.56) | KMT2AMEN1ALDH1A1HPGDNPC1 | |
| SCHEMBL11591975 | 0.82 | GAA (0.59) | KMT2AMEN1CYP2C19ALDH1A1HPGD | |
| SCHEMBL12366164 | 0.82 | TSHR (0.58) | KMT2AMEN1ALDH1A1HPGDPOLB | |
| SCHEMBL12366190 | 0.82 | ALDH1A1 (0.57) | KMT2AMEN1ALDH1A1HPGDNPC1 | |
| SCHEMBL12366121 | 0.80 | LMNA (0.64) | KMT2AMEN1ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL6366481 | 0.79 | ALDH1A1 (0.57) | ALDH1A1RAB9AGAASMN1; SMN2HTT | |
| SCHEMBL12366117 | 0.79 | HDAC1 (0.56) | ALDH1A1NPC1RAB9APOLBCA12 |
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 |