Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.49 |
| ▸ | USP1 | O94782 | 1/20 | 0.47 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.47 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | TYMS | P04818 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29558270 | 0.92 | APP (0.48) | NPY5RSLC2A1MEN1POLBKMT2A | |
| SCHEMBL29559170 | 0.90 | ABCG2 (0.44) | NPY5RUSP1WDR48SLC2A1MEN1 | |
| SCHEMBL28725367 | 0.83 | USP1 (0.51) | USP1WDR48KMT2ARPS6KB1DYRK1A | |
| SCHEMBL29558289 | 0.83 | USP1 (0.51) | USP1WDR48KMT2ARPS6KB1DYRK1A | |
| SCHEMBL29558591 | 0.82 | HRH4 (0.41) | NPY5RUSP1WDR48MEN1KMT2A | |
| SCHEMBL29559166 | 0.81 | SOS1 (0.59) | MEN1POLBKMT2AMAPK1ALDH1A1 | |
| SCHEMBL29559492 | 0.80 | FLT1 (0.56) | NPY5RMEN1POLBKMT2AMAPK1 | |
| SCHEMBL29558650 | 0.79 | CTNNB1 (0.46) | MEN1POLBKMT2AALDH1A1MAPT | |
| SCHEMBL29558870 | 0.78 | APP (0.47) | LMNAHTT | |
| SCHEMBL29559506 | 0.77 | MEN1 (0.59) | MEN1KMT2AMAPK1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380753-A | Aryl or heteroaryl substituted quinoxaline-2, 3-diamine compound and antibacterial application thereof | 中国医学科学院药物研究所 | 2022-04-22 | — | — | CN | claimed |
| CN-114380753-A | Aryl or heteroaryl substituted quinoxaline-2, 3-diamine compound and antibacterial application thereof | 中国医学科学院药物研究所 | 2022-04-22 | — | — | CN | disclosed |