Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC1 | P07992 | 3/20 | 0.53 |
| ▸ | ERCC4 | Q92889 | 3/20 | 0.53 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2266096 | 0.85 | P2RX7 (0.50) | ERCC1ERCC4MCL1P2RX7NPC1 | |
| SCHEMBL2265823 | 0.85 | ALDH1A1 (0.58) | ERCC1ERCC4MCL1P2RX7ALDH1A1 | |
| SCHEMBL2266083 | 0.83 | P2RX7 (0.54) | ERCC1ERCC4MCL1F2P2RX7 | |
| SCHEMBL23565573 | 0.82 | ERCC1 (0.58) | ERCC1ERCC4P2RX7ALDH1A1CNR1 | |
| SCHEMBL2263310 | 0.81 | MCL1 (0.51) | MCL1P2RX7 | |
| SCHEMBL7934896 | 0.81 | ERCC1 (0.57) | ERCC1ERCC4P2RX7ALDH1A1CNR1 | |
| SCHEMBL2391525 | 0.81 | MCL1 (0.49) | ERCC1ERCC4MCL1P2RX7 | |
| SCHEMBL2264466 | 0.80 | MCL1 (0.50) | ERCC1ERCC4MCL1P2RX7ALDH1A1 | |
| SCHEMBL2265012 | 0.79 | MCL1 (0.50) | ERCC1ERCC4MCL1P2RX7ALDH1A1 | |
| SCHEMBL2266698 | 0.79 | MCL1 (0.61) | MCL1ALDH1A1NPC1RAB9A |
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-2020249821-A1 | NOVEL ARGINASE INHIBITORS | RIJKSUNIVERSITEIT GRONINGEN (NL) | 2020-12-17 | — | — | WO | disclosed |