Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL2102580 | 0.84 | RBP4 (0.34) | MAPK14 | |
| SCHEMBL2102582 | 0.84 | RBP4 (0.34) | MAPK14 | |
| SCHEMBL2100512 | 0.81 | GPR119 (0.44) | — | |
| SCHEMBL2100515 | 0.81 | GPR119 (0.44) | — | |
| SCHEMBL2099838 | 0.73 | CA1 (0.32) | — | |
| SCHEMBL2099837 | 0.73 | CA1 (0.32) | — | |
| SCHEMBL2604354 | 0.73 | CA1 (0.32) | — | |
| SCHEMBL2606286 | 0.70 | GPR119 (0.42) | — | |
| SCHEMBL2604322 | 0.68 | — | — | |
| SCHEMBL2604351 | 0.67 | CNR2 (0.37) | — |
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-2009020470-A2 | CGRP RECEPTOR ANTAGONISTS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-02-12 | — | — | WO | disclosed |