Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 17/20 | 0.44 |
| ▸ | TNF | P01375 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21182244 | 0.89 | NR3C1 (0.43) | NR3C1TNFNPC1RAB9APGR | |
| SCHEMBL23622254 | 0.89 | NPC1 (0.42) | NR3C1NPC1RAB9AROCK2ROCK1 | |
| SCHEMBL17644001 | 0.86 | NR3C1 (0.61) | NR3C1TNFPGR | |
| SCHEMBL19459958 | 0.86 | NR3C1 (0.61) | NR3C1TNFPGR | |
| SCHEMBL23622250 | 0.85 | NR3C1 (0.57) | NR3C1TNFPGR | |
| SCHEMBL23622263 | 0.81 | MEN1 (0.43) | NPC1RAB9AROCK2ROCK1MEN1 | |
| SCHEMBL23622154 | 0.80 | NR3C1 (0.55) | NR3C1TNFPGR | |
| SCHEMBL23622136 | 0.79 | NR3C1 (0.47) | NR3C1TNFPGRROCK2 | |
| SCHEMBL23622256 | 0.77 | NR3C1 (0.48) | NR3C1PGRROCK2ROCK1 | |
| SCHEMBL23622255 | 0.74 | NR3C1 (0.43) | NR3C1TNFNPC1RAB9AROCK2 |
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-2021136429-A1 | BENZOPYRAZOLE COMPOUND | 南京明德新药研发有限公司 | 2021-07-08 | — | — | WO | disclosed |