Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KDM4A | O75164 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16790455 | 1.00 | ATR (0.50) | ATRNAMPTTDP1KDM4EALDH1A1 | |
| SCHEMBL16767712 | 0.88 | NAMPT (0.45) | ATRNAMPTTDP1KDM4EALDH1A1 | |
| SCHEMBL31569428 | 0.87 | ATR (0.45) | ATRNAMPTTDP1KDM4EALDH1A1 | |
| SCHEMBL1631864 | 0.82 | ADORA2A (0.48) | NAMPTL3MBTL1KDM4ACYP3A4AKT1 | |
| SCHEMBL30890544 | 0.82 | CHRM2 (0.47) | NAMPTKDM4EALDH1A1L3MBTL1KDM4A | |
| SCHEMBL18764702 | 0.81 | NAMPT (0.46) | NAMPTKDM4EL3MBTL1KDM4ACYP3A4 | |
| SCHEMBL1631862 | 0.81 | NAMPT (0.46) | ATRNAMPTKDM4EL3MBTL1KDM4A | |
| SCHEMBL13095208 | 0.80 | NAMPT (0.45) | NAMPTKDM4EL3MBTL1KDM4ACYP3A4 | |
| SCHEMBL21730231 | 0.80 | NAMPT (0.47) | NAMPTKDM4EL3MBTL1KDM4AKCNA5 | |
| SCHEMBL28950604 | 0.80 | NAMPT (0.45) | NAMPTKDM4EL3MBTL1KDM4AKCNA5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115181092-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-115181092-A | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-112279837-B | Pyrazine compounds and uses thereof | 迪哲(江苏)医药股份有限公司 | 2022-08-09 | — | — | CN | disclosed |