Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6778880 | 0.76 | CA1 (0.41) | CA1CA2 | |
| SCHEMBL7348641 | 0.76 | ITGB3 (0.43) | — | |
| SCHEMBL6778246 | 0.75 | FOLH1 (0.32) | CA1CA2CA9 | |
| SCHEMBL6773948 | 0.73 | ITGB3 (0.43) | — | |
| SCHEMBL6783139 | 0.67 | HTT (0.42) | — | |
| SCHEMBL6776568 | 0.66 | HTT (0.39) | — | |
| SCHEMBL7340558 | 0.61 | EPHX2 (0.39) | — | |
| SCHEMBL6783445 | 0.61 | KMT2A (0.40) | — | |
| SCHEMBL6773426 | 0.60 | MAPK1 (0.45) | — | |
| SCHEMBL7080325 | 0.59 | ITGB3 (0.64) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0850221-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1998-07-01 | — | — | EP | disclosed |
| WO-1997008145-A1 | META-GUANIDINE, UREA, THIOUREA OR AZACYCLIC AMINO BENZOIC ACID DERIVATIVES AS INTEGRIN ANTAGONISTS | G.D. SEARLE & CO. (US) | 1997-03-06 | — | — | WO | disclosed |