Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 12/20 | 1.00 |
| ▸ | PDCD1 | Q15116 | 10/20 | 1.00 |
| ▸ | SLC11A2 | P49281 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22908684 | 0.86 | CD274 (1.00) | CD274PDCD1SLC11A2KDM4EMAPT | |
| SCHEMBL22908607 | 0.85 | CD274 (1.00) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL22908621 | 0.83 | CD274 (1.00) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL14559416 | 0.81 | CD274 (0.68) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL22908681 | 0.80 | CD274 (1.00) | CD274PDCD1SLC11A2KDM4EMAPT | |
| SCHEMBL7445177 | 0.78 | CD274 (0.64) | CD274PDCD1SLC11A2KDM4EMAPT | |
| SCHEMBL22909491 | 0.77 | CD274 (1.00) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL9382369 | 0.76 | CD274 (0.77) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL16979677 | 0.74 | CD274 (0.74) | CD274PDCD1KDM4EMAPTTDP1 | |
| SCHEMBL22909488 | 0.74 | CD274 (1.00) | CD274PDCD1KDM4EALDH1A1L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021009384-A1 | NOVEL PYRAZOLONE DERIVATIVES AS PD-1/PD-L1 INTERACTION INHIBITORS | CENTRE HOSPITALIER REGIONAL UNIVERSITAIRE DE LILLE (FR) | 2021-01-21 | — | — | WO | disclosed |