Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 17/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 17/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30550498 | 1.00 | ESR1 (0.42) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL22307199 | 0.87 | PDCD1 (0.45) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL29372980 | 0.87 | PDCD1 (0.45) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL20295957 | 0.85 | ELANE (0.40) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL30958027 | 0.80 | ESR1 (0.39) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL28863814 | 0.80 | ESR1 (0.39) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL28661751 | 0.80 | PDCD1 (0.38) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL28667803 | 0.79 | MAPT (0.39) | ESR1ESR2PDCD1CD274 | |
| SCHEMBL28602614 | 0.78 | PDCD1 (0.41) | PDCD1CD274 | |
| SCHEMBL30058938 | 0.78 | PDCD1 (0.41) | PDCD1CD274 |
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-116514802-A | Indoline immunoregulation inhibitor and pharmaceutical composition and application thereof | 昆药集团股份有限公司 | 2023-08-01 | — | — | CN | disclosed |
| CN-113801111-A | Biphenyl derivative inhibitor and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2021-12-17 | — | — | CN | disclosed |