Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23181766 | 0.76 | CHRM2 (0.31) | — | |
| SCHEMBL14217262 | 0.73 | — | — | |
| SCHEMBL1864085 | 0.73 | — | — | |
| SCHEMBL14217338 | 0.73 | — | — | |
| SCHEMBL11786257 | 0.72 | — | — | |
| SCHEMBL18650083 | 0.70 | ALDH1A1 (0.30) | — | |
| SCHEMBL22943180 | 0.70 | ALDH1A1 (0.30) | — | |
| SCHEMBL28828063 | 0.70 | CHRM2 (0.38) | — | |
| SCHEMBL13253205 | 0.67 | — | — | |
| SCHEMBL15013859 | 0.67 | — | — |
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-2004082687-A1 | LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-09-30 | — | — | WO | disclosed |