Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 8/20 | 0.37 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | CCR5 | P51681 | 1/20 | 0.35 |
| ▸ | CCR8 | P51685 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL21816586 | 0.81 | CYP1A2 (0.31) | GRM5CYP1A2CYP2E1CYP2A6CYP2B6 | |
| SCHEMBL21816580 | 0.79 | KDM4E (0.39) | GRM5CYP1A2 | |
| SCHEMBL1306099 | 0.78 | GRM5 (0.40) | GRM5CCR1CCR5CCR8HDAC6 | |
| SCHEMBL15384097 | 0.76 | EGLN1 (0.39) | GRM5CCR1CCR5CCR8HDAC6 | |
| SCHEMBL14571166 | 0.73 | MAPT (0.42) | GRM5CCR1CCR5CCR8HDAC6 | |
| SCHEMBL1457390 | 0.72 | APP (0.33) | — | |
| SCHEMBL1457127 | 0.72 | ACACB (0.38) | CYP2A6 | |
| SCHEMBL30283030 | 0.72 | APP (0.44) | — | |
| SCHEMBL2609821 | 0.72 | ACACB (0.38) | GRM5 | |
| SCHEMBL13644960 | 0.72 | HDAC8 (0.38) | — |
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-2012103309-A2 | POLYMERIC SYSTEMS CONTAINING CHROMOPHORIC UNITS FOR PHOTO-DRIVEN CATALYSIS AND WATER SPLITTING | THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) | 2012-08-02 | — | — | WO | disclosed |