Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 3/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 1/20 | 0.36 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL21850227 | 0.84 | ALDH1A1 (0.39) | CYP4F2CYP4A11CYP3A4CYP1A2ABCB11 | |
| SCHEMBL18383144 | 0.79 | ALDH1A1 (0.49) | ALDH1A1KMT2AMEN1SMN1; SMN2HPGD | |
| SCHEMBL12960396 | 0.78 | CYP1A2 (0.37) | CYP3A4CYP1A2TSHRCYP2C19ALDH1A1 | |
| SCHEMBL16985342 | 0.77 | GRIA1 (0.37) | ALDH1A1KMT2AMEN1KDM4EGRIA1 | |
| SCHEMBL30867737 | 0.76 | PDE4A (0.35) | CYP4F2CYP4A11CYP3A4CYP1A2ABCB11 | |
| SCHEMBL16985341 | 0.75 | GRIA1 (0.36) | KMT2AGRIA1GRIA2GRIA3GRIA4 | |
| SCHEMBL574545 | 0.73 | RAB9A (0.48) | CYP3A4TSHRCYP2C19ALDH1A1KMT2A | |
| SCHEMBL9877609 | 0.73 | SMN1; SMN2 (0.51) | CYP3A4CYP1A2TSHRCYP2C19ALDH1A1 | |
| SCHEMBL15339562 | 0.72 | ALDH1A1 (0.38) | CYP4F2CYP4A11ALDH1A1KMT2AMEN1 | |
| SCHEMBL20117304 | 0.72 | KMO (0.48) | CYP4F2CYP4A11CYP1A2TSHRCYP2C19 |
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-2015113452-A1 | COMPOUNDS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2015-08-06 | — | — | WO | disclosed |