Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YWHAH | Q04917 | 6/20 | 1.00 |
| ▸ | KCNH2 | Q12809 | 1/20 | 1.00 |
| ▸ | TP53 | P04637 | 11/20 | 0.81 |
| ▸ | POLB | P06746 | 2/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL30490434 | 0.93 | YWHAH (0.90) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490432 | 0.93 | YWHAH (1.00) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490431 | 0.87 | TP53 (0.91) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490429 | 0.86 | YWHAH (1.00) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490428 | 0.84 | YWHAH (0.79) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490436 | 0.81 | TP53 (0.77) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL30490435 | 0.74 | TP53 (0.73) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL2555312 | 0.70 | TP53 (0.59) | YWHAHKCNH2TP53POLBMAPT | |
| SCHEMBL29845649 | 0.70 | TP53 (0.87) | YWHAHTP53POLBMAPT | |
| SCHEMBL29845533 | 0.69 | TP53 (0.84) | YWHAHTP53POLBMAPT |
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-116554080-A | 1H-indole-2-carboxylic acid derivative, pharmaceutical composition and application | 深圳市坤健创新药物研究院 | 2023-08-08 | — | — | CN | disclosed |