Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 2/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30646051 | 1.00 | MAPT (0.44) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL1895559 | 0.80 | PDGFRA (0.65) | KDRMETPDGFRA | |
| SCHEMBL29111050 | 0.80 | KDR (0.48) | RAB9AKDRMETFLT3AURKB | |
| SCHEMBL4236466 | 0.78 | MAPT (0.53) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL14451809 | 0.78 | MAPT (0.56) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL29111055 | 0.77 | PDGFRA (0.48) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL30645978 | 0.77 | PDGFRA (0.48) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL13915775 | 0.76 | MAPT (0.53) | MAPTSMN1; SMN2NPC1RAB9ANFKB1 | |
| SCHEMBL29111056 | 0.76 | KDR (0.45) | KDRMETFLT3AURKBMEN1 | |
| SCHEMBL30646069 | 0.76 | KDR (0.45) | KDRMETFLT3AURKBMEN1 |
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-111253385-B | Heterocyclic compound, preparation method and application | 遵义医科大学珠海校区 | 2023-11-24 | — | — | CN | disclosed |
| CN-111253385-A | Heterocyclic compound, preparation method and application | 遵义医科大学珠海校区 | 2020-06-09 | — | — | CN | disclosed |