Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.44 |
| ▸ | CA1 | P00915 | 5/20 | 0.44 |
| ▸ | CA2 | P00918 | 5/20 | 0.44 |
| ▸ | CA9 | Q16790 | 5/20 | 0.44 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | ITK | Q08881 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | FPR3 | P25089 | 2/20 | 0.36 |
| ▸ | FPR2 | P25090 | 2/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.36 |
| ▸ | STK17B | O94768 | 1/20 | 0.35 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL21395510 | 0.88 | CA12 (0.45) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30189776 | 0.88 | CA12 (0.45) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30189817 | 0.88 | CA12 (0.43) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19783101 | 0.88 | CA12 (0.43) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30189608 | 0.87 | CA12 (0.44) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19782885 | 0.87 | CA12 (0.44) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19783253 | 0.84 | CA12 (0.41) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19783453 | 0.83 | SCN9A (0.41) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19782950 | 0.78 | LMNA (0.38) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL10086777 | 0.77 | CA12 (0.53) | CA12CA1CA2CA9PDK2 |
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-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| WO-2018013774-A1 | BICYCLIC HETEROARYL SUBSTITUTED COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2018-01-18 | — | — | WO | disclosed |