Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.54 |
| ▸ | MERTK | Q12866 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.48 |
| ▸ | CKS1B | P61024 | 1/20 | 0.45 |
| ▸ | SKP1 | P63208 | 1/20 | 0.45 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.45 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | AKT1 | P31749 | 1/20 | 0.41 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL15252462 | 0.83 | CKS1B (0.52) | PARP1CKS1BSKP1SKP2KCNA3 | |
| SCHEMBL18918808 | 0.81 | PARP1 (0.57) | PARP1MERTKNAMPTCKS1BSKP1 | |
| SCHEMBL22650456 | 0.81 | GABRP (0.48) | PARP1GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL30657804 | 0.80 | PARP1 (0.57) | PARP1MERTKNAMPTCKS1BSKP1 | |
| SCHEMBL31267085 | 0.79 | PARP1 (0.53) | PARP1MERTKNAMPTCFTRHDAC3 | |
| SCHEMBL4700826 | 0.79 | PARP1 (0.50) | PARP1MERTKNAMPTCKS1BSKP1 | |
| SCHEMBL29979363 | 0.78 | NAMPT (0.65) | PARP1NAMPTCFTRHDAC3HDAC1 | |
| SCHEMBL22650451 | 0.77 | PARP1 (0.44) | PARP1MERTKNAMPTCKS1BSKP1 | |
| SCHEMBL12644375 | 0.77 | NAMPT (0.70) | PARP1NAMPTCKS1BSKP1SKP2 | |
| SCHEMBL29268404 | 0.77 | NPC1 (0.49) | PARP1MERTKNAMPTCFTRMCL1 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |