Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.56 |
| ▸ | PLK1 | P53350 | 1/20 | 0.56 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | NQO1 | P15559 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 4/20 | 0.50 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.50 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.50 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL851386 | 0.85 | MAPT (0.53) | PARP10PLK1RAB9AALDH1A1TSHR | |
| SCHEMBL12045721 | 0.85 | L3MBTL1 (0.41) | PARP10NPC1PLK1NPSR1ALDH1A1 | |
| SCHEMBL12045743 | 0.83 | TP53 (0.64) | PLA2G4BTSHRL3MBTL1 | |
| SCHEMBL8813448 | 0.82 | TP53 (0.67) | NPC1PLA2G4BRAB9ATSHR | |
| SCHEMBL841269 | 0.81 | GAA (0.59) | PLA2G4BTSHRMAOBMAOAPRSS1 | |
| SCHEMBL11468841 | 0.81 | PARP10 (0.59) | PARP10NPC1PLK1PLA2G4BKMT2A | |
| SCHEMBL839292 | 0.80 | RARB (0.49) | PARP10RAB9AALDH1A1MAOBPRSS1 | |
| SCHEMBL851175 | 0.80 | PARP10 (0.61) | PARP10NPC1RAB9AMAOBMAOA | |
| SCHEMBL12045708 | 0.80 | PARP10 (0.61) | PARP10NPC1RAB9AMAOBMAOA | |
| SCHEMBL2122823 | 0.79 | CES2 (0.59) | PARP10PLK1KMT2ANPSR1RAB9A |
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-112300157-B | Novel pyrazolopyridine compound with anti-tumor activity and preparation method thereof | 烟台大学 | 2021-08-20 | — | — | CN | disclosed |
| CN-112300157-A | Novel pyrazolopyridine compound with anti-tumor activity and preparation method thereof | 烟台大学 | 2021-02-02 | — | — | CN | disclosed |