Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.57 |
| ▸ | CA1 | P00915 | 5/20 | 0.57 |
| ▸ | CA2 | P00918 | 5/20 | 0.57 |
| ▸ | CA9 | Q16790 | 5/20 | 0.57 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.55 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL19783401 | 1.00 | CA12 (0.57) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL13306448 | 0.86 | CA12 (0.63) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL28350739 | 0.84 | PDK2 (0.56) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL7348907 | 0.84 | CA12 (0.60) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19782825 | 0.83 | CA12 (0.59) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL21017935 | 0.83 | CA1 (0.64) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL30189758 | 0.82 | CA12 (0.53) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19783376 | 0.82 | CA12 (0.53) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL19788405 | 0.81 | CA12 (0.59) | CA12CA1CA2CA9PDK2 | |
| SCHEMBL16882385 | 0.80 | CA12 (0.56) | 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 1 patent. 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 |