Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2664412 | 0.83 | CA12 (0.47) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL11695305 | 0.82 | SMN1; SMN2 (0.44) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL9570558 | 0.82 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL1527162 | 0.82 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL3269301 | 0.79 | MAPT (0.59) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL2651404 | 0.79 | ALDH1A1 (0.50) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL10457902 | 0.79 | ALDH1A1 (0.50) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL3248566 | 0.79 | CNR1 (0.50) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL149947 | 0.79 | IDO1 (0.60) | ALDH1A1HPGDSMN1; SMN2HTTLMNA | |
| SCHEMBL2650270 | 0.79 | ALDH1A1 (0.50) | ALDH1A1HPGDSMN1; SMN2HTTLMNA |
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-113454086-A | Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists | 百济神州有限公司 | 2021-09-28 | — | — | CN | disclosed |