Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.42 |
| ▸ | CA1 | P00915 | 6/20 | 0.42 |
| ▸ | CA2 | P00918 | 6/20 | 0.42 |
| ▸ | CA9 | Q16790 | 6/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL12721608 | 1.00 | CA12 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL12721631 | 1.00 | CA12 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL20419271 | 1.00 | CA12 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL19976416 | 0.89 | CA9 (0.48) | CA12CA1CA2CA9TSHR | |
| SCHEMBL6973373 | 0.89 | ALDH1A1 (0.38) | CA12CA1CA2CA9TSHR | |
| SCHEMBL13344568 | 0.88 | CA12 (0.39) | CA12CA1CA2CA9TSHR | |
| SCHEMBL1626249 | 0.83 | CA2 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL1626250 | 0.83 | CA2 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL20776462 | 0.83 | CA12 (0.42) | CA12CA1CA2CA9TSHR | |
| SCHEMBL1627640 | 0.83 | CA2 (0.42) | CA12CA1CA2CA9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024059609-A1 | PHARMACEUTICAL FORMS OF A CD73 INHIBITOR | ORIC PHARMACEUTICALS, INC. (US) | 2024-03-21 | — | — | WO | disclosed |
| WO-2023147161-A2 | NICOTINATE AND NICOTINAMIDE RIBOSIDE-BASED COMPOUNDS AND DERIVATIVES THEREOF | New Frontier Bio, Inc. (US) | 2023-08-03 | — | — | WO | disclosed |