Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL13679748 | 0.88 | ABCB1 (0.52) | ABCB1APP | |
| SCHEMBL13679705 | 0.85 | ABCB1 (0.67) | ABCB1 | |
| SCHEMBL3827087 | 0.82 | ABCB1 (0.44) | ABCB1 | |
| SCHEMBL3827085 | 0.82 | ABCB1 (0.44) | ABCB1 | |
| SCHEMBL13679704 | 0.81 | ABCB1 (0.42) | ABCB1APP | |
| SCHEMBL13679681 | 0.81 | ABCB1 (0.43) | ABCB1 | |
| SCHEMBL719051 | 0.80 | ABCB1 (0.74) | ABCB1 | |
| SCHEMBL13679694 | 0.76 | ABCB1 (0.40) | ABCB1 | |
| SCHEMBL13679706 | 0.76 | ACHE (0.43) | ABCB1 | |
| SCHEMBL5468481 | 0.75 | ABCB1 (0.67) | ABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0999835-B1 | IMIDAZOLE DERIVATIVES AS MDR MODULATORS | TAIJI BIOMEDICAL INC (US) | 2009-09-09 | — | — | EP | disclosed |