Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 6/20 | 0.70 |
| ▸ | CD274 | Q9NZQ7 | 6/20 | 0.70 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.39 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22401073 | 1.00 | PDCD1 (0.70) | PDCD1CD274S1PR1S1PR3SLC6A4 | |
| SCHEMBL13825254 | 0.86 | CD274 (0.66) | PDCD1CD274S1PR1S1PR3PTGS2 | |
| SCHEMBL13368903 | 0.85 | PDCD1 (0.50) | PDCD1CD274SLC6A4SLC6A3PTGS2 | |
| SCHEMBL24665246 | 0.84 | CD274 (0.49) | PDCD1CD274SLC6A4SLC6A3PTGS2 | |
| SCHEMBL29558512 | 0.82 | CD274 (1.00) | PDCD1CD274PTGS1EPHX1 | |
| SCHEMBL358303 | 0.82 | CD274 (1.00) | PDCD1CD274PTGS1EPHX1 | |
| SCHEMBL16245269 | 0.82 | PDCD1 (0.76) | PDCD1CD274S1PR1S1PR3PTGS1 | |
| SCHEMBL13824010 | 0.81 | NR4A2 (0.48) | PDCD1CD274SLC6A4SLC6A3PTGS2 | |
| SCHEMBL1041243 | 0.80 | PDK2 (0.49) | PDCD1CD274SLC6A4SLC6A3PTGS2 | |
| SCHEMBL1443992 | 0.79 | PDCD1 (0.43) | PDCD1CD274SLC6A4SLC6A3PTGS2 |
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-117729921-A | Compounds and methods as PD1/PD-L1 inhibitors | 朱比兰特普罗德尔有限公司 | 2024-03-19 | — | — | CN | disclosed |