Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.59 |
| ▸ | FBP1 | P09467 | 3/20 | 0.57 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.55 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.55 |
| ▸ | P4HB | P07237 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.45 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.45 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.45 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.45 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.45 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.45 |
| ▸ | GSK3B | P49841 | 2/20 | 0.45 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.44 |
| ▸ | SLC9A3 | P48764 | 1/20 | 0.44 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3115027 | 1.00 | AKR1C3 (0.59) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL6981746 | 1.00 | AKR1C3 (0.59) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL6667243 | 0.87 | FBP1 (0.58) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL4238897 | 0.87 | FBP1 (0.58) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL9475839 | 0.86 | PDCD1 (0.51) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL9475845 | 0.86 | PDCD1 (0.51) | AKR1C3FBP1PDCD1CD274P4HB | |
| SCHEMBL31546284 | 0.84 | FBP1 (0.54) | FBP1PDCD1CD274P4HBMAOA | |
| SCHEMBL8746678 | 0.84 | AKR1C3 (0.76) | AKR1C3KDM4ETBXAS1SLC9A1SLC9A3 | |
| SCHEMBL8746676 | 0.84 | AKR1C3 (0.76) | AKR1C3KDM4ETBXAS1SLC9A1SLC9A3 | |
| Balazipone SCHEMBL636109 | 0.83 | PDCD1 (0.55) | FBP1PDCD1CD274P4HBKDM4E |
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-110997627-A | Novel cystobacter amide derivatives | 亥姆霍兹感染研究中心有限公司 | 2020-04-10 | — | — | CN | disclosed |