Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 3/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 6/20 | 0.35 |
| ▸ | PIK3R1 | P27986 | 5/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.35 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3057864 | 0.83 | VCAM1 (0.36) | VCAM1HCAR3ALDH1A1MAPTGAA | |
| SCHEMBL3040881 | 0.75 | VCAM1 (0.45) | VCAM1HCAR3ALDH1A1MAPTGAA | |
| SCHEMBL3057834 | 0.75 | ALDH1A1 (0.50) | VCAM1ALDH1A1MAPTLMNAHPGD | |
| SCHEMBL5692155 | 0.74 | MAPT (0.46) | VCAM1PIK3CDPIK3R1PIK3CBHCAR3 | |
| SCHEMBL5693128 | 0.73 | MAPT (0.39) | VCAM1MAPT | |
| SCHEMBL5278989 | 0.73 | SMN1; SMN2 (0.44) | VCAM1ALDH1A1MAPTGAALMNA | |
| SCHEMBL5693121 | 0.71 | MAPT (0.46) | VCAM1PIK3CDPIK3R1PIK3CBHCAR3 | |
| SCHEMBL5692492 | 0.70 | MAPT (0.42) | VCAM1HCAR3ALDH1A1MAPTLMNA | |
| SCHEMBL4903893 | 0.69 | PGR (0.48) | — | |
| SCHEMBL4903883 | 0.69 | PGR (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1654221-A2 | ANILINE DERIVATIVED ANDROGEN-, GLUCOCORTICOID-, MINERALCORTICOID- AND PROGESTERONE- RECEPTOR MODULATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-05-10 | — | — | EP | disclosed |
| WO-2005000795-A2 | ANILINE DERIVATIVED ANDROGEN-, GLUCOCORTICOID-, MINERALCORTICOID- AND PROGESTERONE- RECEPTOR MODULATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-01-06 | — | — | WO | disclosed |