Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | CA2 | P00918 | 2/20 | 0.55 |
| ▸ | CA9 | Q16790 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.51 |
| ▸ | PRSS1 | P07477 | 4/20 | 0.50 |
| ▸ | CTSG | P08311 | 4/20 | 0.50 |
| ▸ | CTRB1 | P17538 | 4/20 | 0.50 |
| ▸ | CMA1 | P23946 | 4/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5784044 | 0.92 | SMN1; SMN2 (0.55) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL9459929 | 0.89 | SMN1; SMN2 (0.52) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL1968423 | 0.88 | CA12 (0.55) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL11636179 | 0.88 | CA12 (0.55) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL2486914 | 0.88 | SMN1; SMN2 (0.51) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL8823156 | 0.87 | NPC1 (0.48) | CA12CA1CA2CA9SMN1; SMN2 | |
| Iodide SCHEMBL5351689 | 0.86 | CA12 (0.54) | CA12CA1CA2CA9SMN1; SMN2 | |
| Bromide SCHEMBL7614615 | 0.86 | CA12 (0.54) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL3603034 | 0.84 | SMN1; SMN2 (0.48) | CA12CA1CA2CA9SMN1; SMN2 | |
| SCHEMBL14724516 | 0.83 | RAB9A (0.58) | SMN1; SMN2NPC1RAB9AGAAALDH1A1 |
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-112661584-B | Preparation method of photocatalytic N-alkyl amide compound | 大连理工大学 | 2022-08-05 | — | — | CN | disclosed |
| CN-112661584-A | Preparation method of photocatalytic N-alkyl amide compound | 大连理工大学 | 2021-04-16 | — | — | CN | disclosed |