Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.56 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.56 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | PDE4A | P27815 | 1/20 | 0.52 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.52 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.52 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.52 |
| ▸ | CETP | P11597 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | CASP5 | P51878 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28692486 | 0.86 | HTT (0.53) | HTR6HRH4CETPRAB9ASMN1; SMN2 | |
| SCHEMBL17358224 | 0.77 | L3MBTL1 (0.49) | HTR6HRH4KMT2ANPC1RAB9A | |
| SCHEMBL17548980 | 0.75 | ALDH1A1 (0.47) | HTR6HRH4KMT2ANPC1RAB9A | |
| SCHEMBL12645256 | 0.73 | MEN1 (0.54) | HRH4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL821899 | 0.73 | MEN1 (0.59) | HRH4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4092268 | 0.72 | L3MBTL1 (0.63) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL16662387 | 0.71 | POLB (0.48) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL12787961 | 0.71 | MEN1 (0.50) | HRH4KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL17358223 | 0.71 | ALDH1A1 (0.44) | KMT2ANPC1RAB9ASMN1; SMN2MEN1 | |
| SCHEMBL16662280 | 0.70 | TAAR1 (0.71) | KMT2AMEN1NPSR1HTTHPGD |
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-110437167-B | Aromatic vinyl substituted triazine compound and preparation method and application thereof | 浙江工业大学 | 2021-07-27 | — | — | CN | disclosed |
| CN-110511214-B | Diamine substituted aromatic heterocyclic compound and preparation method and application thereof | 浙江工业大学 | 2021-07-27 | — | — | CN | disclosed |