Predicted protein targets (top 20)
| 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 |
| ▸ | VNN1 | O95497 | 2/20 | 0.37 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | PIK3R5 | Q8WYR1 | 1/20 | 0.33 |
| ▸ | PIK3R3 | Q92569 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | KCNK3 | O14649 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27904296 | 0.83 | CA12 (0.58) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL28132587 | 0.83 | CA12 (0.58) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL12510306 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL21805912 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL3723134 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL3991346 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL3716983 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL14645780 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL21806147 | 0.80 | CA12 (0.55) | CA12CA1CA2CA9VNN1 | |
| SCHEMBL21805909 | 0.80 | CA12 (0.55) | CA12CA1CA2CA9VNN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023131122-A1 | FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-07-13 | — | — | WO | disclosed |