Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.38 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1275146 | 0.79 | POLB (0.64) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL2942696 | 0.79 | POLB (0.59) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL81834 | 0.76 | CYP2C9 (0.57) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL1520616 | 0.75 | POLB (1.00) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL23718184 | 0.72 | TSHR (0.84) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL5872380 | 0.72 | CYP2C19 (1.00) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL11766353 | 0.71 | POLB (0.67) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL28295720 | 0.71 | NOS2 (0.61) | POLBMEN1KMT2AHTTKDM4E | |
| SCHEMBL6894899 | 0.70 | POLB (0.57) | POLBCYP2C9CYP2C19ALDH1A1TSHR | |
| SCHEMBL248853 | 0.69 | SMN1; SMN2 (0.42) | ALDH1A1TSHRHTTKDM4ELMNA |
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-2008055959-A1 | NOVEL COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES | GALAPAGOS N.V. (BE) | 2008-05-15 | — | — | WO | disclosed |