Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 11/20 | 0.60 |
| ▸ | CD274 | Q9NZQ7 | 11/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5533081 | 1.00 | PDCD1 (0.60) | PDCD1CD274SLC6A3SLC6A4LMNA | |
| SCHEMBL19849652 | 0.87 | TSHR (0.53) | SLC6A3SLC6A4LMNATSHRHTT | |
| SCHEMBL29634134 | 0.87 | TSHR (0.53) | SLC6A3SLC6A4LMNATSHRHTT | |
| SCHEMBL27843639 | 0.85 | SLC6A3 (0.74) | PDCD1CD274SLC6A3SLC6A4LMNA | |
| SCHEMBL1775832 | 0.85 | SLC6A3 (0.74) | PDCD1CD274SLC6A3SLC6A4LMNA | |
| SCHEMBL24665233 | 0.85 | SLC6A3 (0.74) | PDCD1CD274SLC6A3SLC6A4TSHR | |
| SCHEMBL20200106 | 0.85 | KDM4E (0.60) | PDCD1CD274SLC6A3SLC6A4LMNA | |
| SCHEMBL30012190 | 0.85 | SLC6A3 (0.74) | PDCD1CD274SLC6A3SLC6A4TSHR | |
| SCHEMBL28684512 | 0.84 | PTGER1 (0.52) | PDCD1CD274SLC6A3SLC6A4LMNA | |
| SCHEMBL28692302 | 0.84 | ASH1L (0.49) | PDCD1CD274SLC6A3SLC6A4TSHR |
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-117186001-B | AHA1 inhibitor with multiple myeloma-resisting activity and preparation method and application thereof | 南京中医药大学 | 2024-09-17 | — | — | CN | disclosed |
| CN-111978200-B | Biphenylamide derivative, preparation method and application | 湖北省生物农药工程研究中心 | 2022-09-13 | — | — | CN | disclosed |