Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | PTGES | O14684 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | ALDH3A1 | P30838 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9986571 | 0.89 | VCAM1 (0.51) | VCAM1MAPTLMNAALDH1A1CYP19A1 | |
| SCHEMBL12065809 | 0.85 | VCAM1 (0.47) | VCAM1MAPTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL12066381 | 0.81 | CA1 (0.46) | MAPTLMNAALDH1A1CYP19A1MEN1 | |
| SCHEMBL6800750 | 0.79 | CYP19A1 (0.61) | MAPTALDH1A1CYP19A1MEN1KMT2A | |
| SCHEMBL29824739 | 0.79 | WNK1 (0.67) | VCAM1MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL17749260 | 0.79 | WNK1 (0.67) | VCAM1MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL30871305 | 0.78 | ALDH1A1 (0.67) | VCAM1MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL6117960 | 0.78 | ALDH1A1 (0.67) | VCAM1MAPTLMNAALDH1A1MEN1 | |
| SCHEMBL23592060 | 0.78 | PDE5A (0.42) | MAPTALDH1A1CYP19A1MEN1KMT2A | |
| SCHEMBL23592059 | 0.78 | CSNK2A1 (0.42) | MAPTLMNAALDH1A1CYP19A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011149827-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-12-01 | — | — | WO | disclosed |
| WO-2011149827-A1 | COMPOUNDS AND METHODS | GLAXOSMITHKLINE LLC (US) | 2011-12-01 | — | — | WO | disclosed |