Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 5/20 | 0.50 |
| ▸ | RORA | P35398 | 5/20 | 0.50 |
| ▸ | RORC | P51449 | 5/20 | 0.50 |
| ▸ | RORB | Q92753 | 5/20 | 0.50 |
| ▸ | ALPG | P10696 | 3/20 | 0.47 |
| ▸ | ALPL | P05186 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 3/20 | 0.43 |
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.42 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.42 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.42 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.42 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.42 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28840681 | 0.76 | KIF11 (0.49) | ALDH1A1TDP1L3MBTL1KDM4EHPGD | |
| SCHEMBL28840669 | 0.76 | CYP19A1 (0.56) | PGRALDH1A1TDP1L3MBTL1KDM4E | |
| SCHEMBL1335135 | 0.75 | PGR (0.73) | PGRRORARORCRORBALPG | |
| SCHEMBL29531665 | 0.75 | PGR (0.73) | PGRRORARORCRORBALPG | |
| SCHEMBL27543756 | 0.72 | ALDH1A1 (0.66) | PGRRORARORCRORBALPG | |
| SCHEMBL27967763 | 0.72 | PGR (0.52) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL278343 | 0.70 | PGR (0.66) | PGRRORARORCRORBCNR2 | |
| SCHEMBL1921229 | 0.70 | RORA (0.56) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL10730998 | 0.69 | PGR (0.70) | PGRRORARORCRORBALDH1A1 | |
| SCHEMBL10654147 | 0.69 | PGR (0.55) | PGRRORARORCRORBALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115028655-B | 2-trifluoromethyl-3-iodo-indole compound and preparation method thereof | 上海大学 | 2024-01-16 | — | — | CN | disclosed |
| CN-115028655-A | 2-trifluoromethyl-3-iodine-indole compound and preparation method thereof | 上海大学 | 2022-09-09 | — | — | CN | disclosed |