Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 9/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 8/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.44 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.43 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL23535858 | 0.72 | CYP11B2 (0.58) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL20519574 | 0.72 | CYP11B1 (0.54) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL20524347 | 0.72 | CYP11B1 (0.54) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL20519343 | 0.71 | CYP11B1 (0.51) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL30107166 | 0.71 | CYP11B1 (0.51) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL6929673 | 0.71 | CYP11B1 (0.75) | CYP11B2CYP11B1HSP90AA1HSP90AB1IDO1 | |
| SCHEMBL15507125 | 0.70 | CYP11B1 (0.61) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL31138699 | 0.70 | CYP11B1 (0.56) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL28941444 | 0.70 | CYP11B1 (0.61) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 | |
| SCHEMBL8129319 | 0.70 | CYP11B2 (0.62) | CYP11B2CYP11B1HSP90AA1HSP90AB1CYP19A1 |
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-110678466-B | Diazanaphthalenes as HPK1 inhibitors | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |