Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.34 |
| ▸ | CA2 | P00918 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL9266659 | 0.85 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL20188848 | 0.79 | GAA (0.36) | CA1CA2TSHR | |
| SCHEMBL8935945 | 0.77 | CA2 (0.37) | CA2 | |
| SCHEMBL23248621 | 0.77 | CA2 (0.37) | CA2 | |
| SCHEMBL8456330 | 0.77 | GAA (0.37) | CA1CA2TSHR | |
| SCHEMBL6947256 | 0.77 | USP2 (0.34) | CA1CA2TSHR | |
| SCHEMBL5015012 | 0.76 | CA2 (0.38) | CA2 | |
| SCHEMBL9160939 | 0.75 | USP2 (0.34) | CA1CA2TSHR | |
| SCHEMBL8911619 | 0.74 | CA1 (0.37) | CA1CA2TSHR | |
| SCHEMBL9505796 | 0.73 | ECE1 (0.36) | CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5679810-A | AMIDE OR ESTER LINKAGES; COMPLEXES PARAMAGNETIC METAL IONS; DIAGNOSTIC IMAGING | SALUTAR, INC. (US) | 1997-10-21 | — | — | US | disclosed |