Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.56 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 10/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.34 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.32 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29601246 | 0.77 | P2RX7 (0.57) | P2RX7LMNAALDH1A1MAPTHSP90AB1 | |
| SCHEMBL29601518 | 0.77 | P2RX7 (0.53) | P2RX7CDK1LMNATP53ALDH1A1 | |
| SCHEMBL29601933 | 0.76 | P2RX7 (0.56) | P2RX7CDK1LMNATP53YTHDC1 | |
| SCHEMBL29601397 | 0.76 | P2RX7 (0.35) | P2RX7 | |
| SCHEMBL19204899 | 0.74 | P2RX7 (0.61) | P2RX7LMNAALDH1A1YTHDC1HDAC3 | |
| SCHEMBL29601383 | 0.71 | P2RX7 (0.61) | P2RX7ALDH1A1HDAC3HDAC4HDAC1 | |
| SCHEMBL29601249 | 0.71 | P2RX7 (0.50) | P2RX7LMNATP53ALDH1A1 | |
| SCHEMBL183035 | 0.70 | CDK1 (0.68) | P2RX7CDK1LMNATP53ALDH1A1 | |
| SCHEMBL29426225 | 0.70 | CDK1 (0.68) | P2RX7CDK1LMNATP53ALDH1A1 | |
| SCHEMBL18832304 | 0.69 | P2RX7 (0.48) | P2RX7LMNATP53YTHDC1HSP90AB1 |
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-3997089-A1 | CYSTEINE BINDING COMPOSITIONS AND METHODS OF USE THEREOF | University Of Virginia Patent Foundation (US) | 2022-05-18 | — | — | EP | claimed |