Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.37 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.37 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 4/20 | 0.36 |
| ▸ | DRD5 | P21918 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | DRD3 | P35462 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23093119 | 1.00 | NR3C1 (0.43) | NR3C1L3MBTL1KCNN1KCNN2KCNN3 | |
| SCHEMBL24265692 | 0.77 | RECQL (0.56) | L3MBTL1ADORA2AADORA1HTTALDH1A1 | |
| SCHEMBL29802514 | 0.77 | DRD4 (0.38) | L3MBTL1KCNN1KCNN2KCNN3DRD4 | |
| SCHEMBL23093159 | 0.77 | DRD4 (0.38) | L3MBTL1KCNN1KCNN2KCNN3DRD4 | |
| SCHEMBL18980077 | 0.72 | RAB9A (0.58) | NR3C1HTTPTGS1PTGS2ALDH1A1 | |
| SCHEMBL17682603 | 0.72 | GAA (0.38) | NR3C1ADORA3ADORA2AADORA1KMT2A | |
| SCHEMBL31469691 | 0.72 | GAA (0.38) | NR3C1ADORA3ADORA2AADORA1KMT2A | |
| SCHEMBL26715046 | 0.71 | ALDH1A1 (0.46) | L3MBTL1ADORA3ADORA2AADORA1ALDH1A1 | |
| SCHEMBL23093442 | 0.70 | FGFR1 (0.40) | DRD4DRD5DRD2DRD3HTT | |
| SCHEMBL29802502 | 0.70 | FGFR1 (0.40) | DRD4DRD5DRD2DRD3HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4027993-A1 | CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF | The Broad Institute Inc. (US) | 2022-07-20 | — | — | EP | disclosed |