Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20819288 | 0.79 | CYP2C19 (0.53) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL9606508 | 0.78 | XDH (0.41) | CYP1A2TSHRKDM4EALDH1A1HPGD | |
| SCHEMBL5933215 | 0.78 | CYP2D6 (0.50) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL27175798 | 0.76 | LMNA (0.48) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL30020918 | 0.76 | LMNA (0.48) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL3507481 | 0.75 | SMN1; SMN2 (0.55) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL3511817 | 0.73 | KMT2A (0.41) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL2448245 | 0.71 | CYP2C9 (0.48) | CYP2C9CYP1A2CYP2C19TSHRCYP2D6 | |
| SCHEMBL3506919 | 0.71 | CD274 (0.41) | NAMPT | |
| SCHEMBL22501730 | 0.70 | ALDH1A1 (0.46) | CYP2C9TSHRNAMPTALDH1A1HSD17B10 |
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-2019053617-A1 | CHEMICAL COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-03-21 | — | — | WO | disclosed |