Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA7 | P43166 | 1/20 | 0.31 |
| ▸ | FSHR | P23945 | 1/20 | 0.30 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.30 |
| ▸ | PLG | P00747 | 1/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13127979 | 0.85 | TSHR (0.41) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL22649551 | 0.81 | TYR (0.41) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL12890775 | 0.79 | TSHR (0.56) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL29068653 | 0.76 | CA1 (0.49) | TSHRLMNAKMT2ACTSKCA1 | |
| SCHEMBL24427421 | 0.76 | HRH3 (0.43) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL24567503 | 0.76 | TSHR (0.41) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL16181347 | 0.75 | TSHR (0.33) | TSHR | |
| SCHEMBL68958 | 0.73 | TSHR (0.43) | TSHRLMNACYP3A4NFKB1ADRA1A | |
| SCHEMBL20854165 | 0.71 | CA1 (0.49) | KMT2ACTSKCA1CA2CA7 | |
| SCHEMBL20854166 | 0.71 | CA1 (0.49) | KMT2ACTSKCA1CA2CA7 |
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-2022140428-A2 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2022-06-30 | — | — | WO | disclosed |