Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRSS1 | P07477 | 6/20 | 0.56 |
| ▸ | F2 | P00734 | 5/20 | 0.56 |
| ▸ | PRSS2 | P07478 | 5/20 | 0.56 |
| ▸ | PRSS3 | P35030 | 5/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 2/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | C1R | P00736 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 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 | |
|---|---|---|---|---|
| SCHEMBL5610254 | 0.79 | F2 (0.61) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL6580084 | 0.79 | F2 (0.65) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL9840763 | 0.77 | F2 (0.68) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL3248145 | 0.76 | CA1 (0.57) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL18537467 | 0.76 | CA1 (0.57) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL10652362 | 0.75 | F2 (0.56) | PRSS1F2PRSS2PRSS3CA2 | |
| SCHEMBL2878187 | 0.75 | F2 (0.56) | PRSS1F2PRSS2PRSS3CA2 | |
| Trimethylammonium SCHEMBL23581573 | 0.74 | CA1 (0.55) | PRSS1F2PRSS2PRSS3CA2 | |
| Trimethylammonium SCHEMBL29177484 | 0.74 | CA1 (0.55) | PRSS1F2PRSS2PRSS3CA2 | |
| Hydrochloric Acid SCHEMBL28348315 | 0.74 | HTR2A (0.55) | PRSS1F2PRSS2PRSS3CA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1846380-A1 | CARDIOVASCULAR COMPOUNDS COMPRISING HETEROCYCLIC NITRIC OXIDE DONOR GROUP COMPOSITIONS AND METHODS OF USE | Nitromed, Inc. (US) | 2007-10-24 | — | — | EP | disclosed |
| WO-2006078995-A1 | CARDIOVASCULAR COMPOUNDS COMPRISING HETEROCYCLIC NITRIC OXIDE DONOR GROUP COMPOSITIONS AND METHODS OF USE | NITROMED, INC. (US) | 2006-07-27 | — | — | WO | disclosed |
| WO-2002014261-A2 | 4-SUBSTITUTED D-GLUTAMIC ACID DERIVATIVES FOR USE AS ANTIBIOTIC | ELI LILLY AND COMPANY (US) | 2002-02-21 | — | — | WO | disclosed |