Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107189 | 1.00 | ABCB1 (0.33) | ABCB1CA1CA2 | |
| SCHEMBL4753975 | 0.89 | CTSS (0.32) | — | |
| SCHEMBL4753924 | 0.87 | MME (0.30) | — | |
| SCHEMBL8097443 | 0.87 | MME (0.30) | — | |
| SCHEMBL1741146 | 0.79 | SMN1; SMN2 (0.35) | CA1CA2 | |
| SCHEMBL1741149 | 0.79 | SMN1; SMN2 (0.35) | CA1CA2 | |
| SCHEMBL1741600 | 0.79 | SMN1; SMN2 (0.35) | CA1CA2 | |
| SCHEMBL8097445 | 0.77 | BIRC2 (0.33) | — | |
| SCHEMBL4751635 | 0.77 | BIRC2 (0.33) | — | |
| SCHEMBL8103738 | 0.77 | — | — |
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-2008151306-A1 | SYNTHESIS OF CYCLODEPSIPEPTIDE COMPOUNDS HAVING ANTINEOPLASTIC AND/OR ANTIMICROBIAL ACTIVITY | ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA, ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2008-12-11 | — | — | WO | disclosed |