Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CCR8 | P51685 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6902522 | 0.91 | CCR1 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6903898 | 0.88 | CYP3A4 (0.37) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6897160 | 0.86 | CCR1 (0.33) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6901825 | 0.86 | ALDH1A1 (0.34) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL7113211 | 0.85 | CCR1 (0.32) | CCR1CCR5CCR8HDAC6DGAT1 | |
| SCHEMBL6902565 | 0.85 | CCR1 (0.32) | CCR1CCR5CCR8HDAC6CYP3A4 | |
| SCHEMBL6900002 | 0.84 | TRPV1 (0.39) | DGAT1 | |
| Hydrochloric Acid SCHEMBL6905100 | 0.84 | DGAT1 (0.33) | CCR1CCR5CCR8HDAC6DGAT1 | |
| Hydrochloric Acid SCHEMBL6900193 | 0.84 | CYP3A4 (0.33) | CCR1CCR5CCR8HDAC6DGAT1 | |
| Hydrochloric Acid SCHEMBL6904707 | 0.84 | CYP3A4 (0.33) | CCR1CCR5CCR8HDAC6DGAT1 |
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-1033371-B1 | Transition metal compound, catalyst system, process for the preparation thereof and its use for the polymerization of olefins | BASELL POLYOLEFINE GMBH (DE) | 2004-01-28 | — | — | EP | claimed |