Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 6/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 7/20 | 0.33 |
| ▸ | BPTF | Q12830 | 1/20 | 0.33 |
| ▸ | IL1B | P01584 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | BTK | Q06187 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CCNK | O75909 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30054302 | 1.00 | NLRP3 (0.36) | NLRP3KAT2BBPTFIL1BRAB9A | |
| SCHEMBL25294649 | 0.83 | KAT2B (0.45) | NLRP3KAT2BBPTFIL1BCCNT1 | |
| SCHEMBL25294648 | 0.83 | KAT2B (0.45) | NLRP3KAT2BBPTFIL1BCCNT1 | |
| SCHEMBL29975473 | 0.81 | KAT2B (0.38) | NLRP3KAT2BBPTFRAB9ANPC1 | |
| SCHEMBL29325958 | 0.81 | KAT2B (0.38) | NLRP3KAT2BBPTFRAB9ANPC1 | |
| SCHEMBL24695702 | 0.80 | CAMK2D (0.45) | NLRP3KAT2BIL1B | |
| SCHEMBL29159546 | 0.80 | CAMK2D (0.45) | NLRP3KAT2BIL1B | |
| SCHEMBL31341807 | 0.78 | ROCK2 (0.45) | NLRP3KAT2B | |
| SCHEMBL29325826 | 0.77 | PDE4A (0.50) | RAB9ANPC1ALDH1A1MAPTHPGD | |
| SCHEMBL25302816 | 0.77 | BTK (0.50) | BTKALDH1A1MAPT |
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-117460718-A | Triazine derivatives and their use in the treatment of cancer | 豪夫迈·罗氏有限公司 | 2024-01-26 | — | — | CN | disclosed |