Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 10/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3025151 | 0.93 | RORC (0.41) | RORCS1PR3ALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL3034768 | 0.92 | RORC (0.41) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL3031514 | 0.88 | RORC (0.42) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL3021119 | 0.85 | S1PR3 (0.39) | RORCS1PR3ALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL3026428 | 0.84 | S1PR3 (0.39) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL3033130 | 0.83 | S1PR3 (0.42) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL3032624 | 0.83 | AR (0.40) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL3029565 | 0.83 | RORC (0.42) | RORCS1PR3ALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL3024952 | 0.82 | AR (0.40) | RORCS1PR3ALDH1A1LMNAGAA | |
| SCHEMBL13108641 | 0.82 | RORC (0.40) | RORCS1PR3ALDH1A1LMNAGAA |
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-2049104-A2 | PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS | SmithKline Beecham Corporation (US) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008021796-A2 | PYRROLIDINONE ANILINES AS PROGESTERONE RECEPTOR MODULATORS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-02-21 | — | — | WO | disclosed |