Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 7/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.40 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.39 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1549633 | 0.79 | KIF11 (0.54) | KIF11CA12CA9SCN2A | |
| SCHEMBL11468663 | 0.79 | KIF11 (0.59) | KIF11CA12CA9SCN2AMAP4K4 | |
| SCHEMBL29818212 | 0.79 | KIF11 (0.59) | KIF11MAP4K4MAOBCLK1 | |
| SCHEMBL1740256 | 0.79 | KIF11 (0.54) | KIF11TRPV1CA12CA9SCN2A | |
| SCHEMBL1549455 | 0.79 | KIF11 (0.48) | KIF11TRPV1CA12CA9SCN2A | |
| SCHEMBL11403140 | 0.77 | KMT2A (0.38) | KIF11TRPV1MAOB | |
| SCHEMBL197238 | 0.76 | KIF11 (0.78) | KIF11MAOB | |
| SCHEMBL29914837 | 0.76 | KIF11 (0.78) | KIF11MAOB | |
| SCHEMBL13410633 | 0.76 | KIF11 (0.78) | KIF11MAOB | |
| SCHEMBL27642441 | 0.76 | KIF11 (0.46) | KIF11TRPV1CA12CA9SCN2A |
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-115521290-A | Preparation of 1, 4-disubstituted indole compound and anti-tumor application thereof | 四川大学华西医院 | 2022-12-27 | — | — | CN | disclosed |