Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13056843 | 0.79 | PARP1 (0.80) | PARP1AURKBKDRMEN1KMT2A | |
| SCHEMBL28895087 | 0.79 | PARP1 (0.46) | PARP1AURKBKMT2AKDM4E | |
| SCHEMBL3600490 | 0.78 | POLB (0.49) | PARP1AURKBKDRMEN1KMT2A | |
| SCHEMBL3600486 | 0.75 | PDE9A (0.58) | PARP1AURKBKDRMEN1KMT2A | |
| SCHEMBL29965925 | 0.74 | ALDH1A1 (0.55) | PARP1AURKBKDRMEN1KMT2A | |
| SCHEMBL28895268 | 0.74 | ALDH1A1 (0.55) | PARP1AURKBKDRMEN1KMT2A | |
| SCHEMBL7026634 | 0.72 | PARP1 (0.55) | PARP1KDRMEN1KMT2APOLB | |
| SCHEMBL13056827 | 0.70 | PARP1 (0.80) | PARP1AURKBMEN1KMT2APOLB | |
| SCHEMBL3595688 | 0.69 | KDR (0.49) | PARP1KDRMEN1KMT2APOLB | |
| SCHEMBL29965987 | 0.69 | PDE5A (0.45) | PARP1 |
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-115368362-A | Quinoxalinone derivatives as BTK inhibitors and application thereof | 华东理工大学 | 2022-11-22 | — | — | CN | disclosed |