Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | RORA | P35398 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.39 |
| ▸ | RORB | Q92753 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | G6PD | P11413 | 1/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21979038 | 1.00 | PGR (0.46) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL22031980 | 0.86 | PGR (0.49) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL22017354 | 0.80 | PGR (0.44) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL22016169 | 0.80 | CYP2C9 (0.49) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL31223920 | 0.79 | PGR (0.46) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL16729412 | 0.78 | KIF11 (0.51) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL21979406 | 0.77 | EGFR (0.39) | SRCMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL27857916 | 0.76 | PGR (0.74) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL13383054 | 0.75 | KIF11 (0.65) | PGRNR1H3KIF11CYP2C9SRC | |
| SCHEMBL18415626 | 0.74 | KIF11 (0.47) | PGRNR1H3KIF11CYP2C9SRC |
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 |
|---|---|---|---|---|---|---|---|
| CN-112969504-B | Compounds for inhibiting alpha 4 beta 7 integrin | 吉利德科学公司 | 2024-04-09 | — | — | CN | disclosed |