Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 11/20 | 0.49 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12309456 | 0.80 | CD274 (0.48) | CD274PDCD1 | |
| SCHEMBL17955664 | 0.75 | CD274 (0.46) | CD274PDCD1 | |
| SCHEMBL13114968 | 0.74 | CD274 (0.48) | CD274PDCD1 | |
| SCHEMBL17689591 | 0.70 | NQO1 (0.42) | — | |
| SCHEMBL20353277 | 0.68 | TAS1R3 (0.49) | TAS1R3TAS1R1 | |
| SCHEMBL28047830 | 0.68 | CD274 (0.43) | CD274PDCD1 | |
| SCHEMBL29292637 | 0.67 | CD274 (0.40) | CD274PDCD1 | |
| SCHEMBL21442861 | 0.67 | PTPN1 (0.40) | CD274PDCD1 | |
| SCHEMBL13114964 | 0.67 | PTPN1 (0.53) | CD274 | |
| SCHEMBL3188344 | 0.67 | CYP1A2 (0.55) | CD274PDCD1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8019550-B2 | Drug discovery method | Keddem Bioscience Ltd. (IL) | 2011-09-13 | — | — | US | disclosed |
| US-8019550-B2 | Drug discovery method | Keddem Bioscience Ltd. (IL) | 2011-09-13 | — | — | US | disclosed |