Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | GCGR | P47871 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24469036 | 0.80 | SHBG (0.33) | — | |
| SCHEMBL7418616 | 0.79 | BACE1 (0.47) | NUDT1PTGDR2METAP2HDAC7ESR2 | |
| SCHEMBL10014387 | 0.77 | PDCD1 (0.50) | PDCD1CD274PTGDR2METAP2HDAC7 | |
| SCHEMBL26651931 | 0.74 | SHBG (0.34) | — | |
| SCHEMBL9485214 | 0.73 | PDCD1 (0.53) | PDCD1CD274PTGDR2HDAC7PTGS1 | |
| SCHEMBL14194630 | 0.73 | PDCD1 (0.53) | PDCD1CD274PTGDR2HDAC7PTGS1 | |
| SCHEMBL22380329 | 0.73 | ALOX15 (0.33) | — | |
| SCHEMBL30306137 | 0.71 | BACE1 (0.41) | PDCD1CD274PTGDR2METAP2HDAC7 | |
| SCHEMBL28221505 | 0.70 | PDCD1 (0.46) | PDCD1CD274ESR2BACE1 | |
| SCHEMBL21670389 | 0.69 | HDAC7 (0.45) | NUDT1PTGDR2METAP2HDAC7PTGS1 |
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-2002022584-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2002-03-21 | — | — | WO | disclosed |