Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.43 |
| ▸ | PLAU | P00749 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.40 |
| ▸ | SLC9A1 | P19634 | 5/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | SLC9A5 | Q14940 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | THPO | P40225 | 3/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL17768977 | 1.00 | TDP1 (0.43) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL20556587 | 0.87 | PLAU (0.43) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL22551928 | 0.83 | NPSR1 (0.40) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL21555702 | 0.81 | ADORA2A (0.49) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL17768976 | 0.80 | SLC9A1 (0.35) | PLAUSLC9A1LMNAADORA2AKMT2A | |
| SCHEMBL17768686 | 0.78 | PLAU (0.32) | PLAUALDH1A1ADORA2AMEN1KMT2A | |
| SCHEMBL21555704 | 0.77 | TDP1 (0.38) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL17768969 | 0.77 | TDP1 (0.38) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL3793535 | 0.76 | TDP1 (0.57) | TDP1PLAUALDH1A1CYP1A2SLC9A1 | |
| SCHEMBL29768708 | 0.76 | TDP1 (0.57) | TDP1PLAUALDH1A1CYP1A2SLC9A1 |
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 |