Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 14/20 | 0.34 |
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.33 |
| ▸ | NPY2R | P49146 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL4053813 | 0.89 | MAPT (0.37) | KCNT1GAARAB9A | |
| SCHEMBL2213566 | 0.87 | GPR119 (0.45) | RAB9A | |
| SCHEMBL2213569 | 0.83 | NR3C2 (0.34) | NR3C2NTRK1CHRM3KCNT1GAA | |
| SCHEMBL4049258 | 0.82 | — | — | |
| SCHEMBL5591928 | 0.81 | CHRM3 (0.35) | CHRM3RAB9A | |
| SCHEMBL2212500 | 0.76 | STS (0.41) | RAB9A | |
| SCHEMBL2213653 | 0.76 | DPP4 (0.46) | RAB9A | |
| SCHEMBL2359872 | 0.70 | TSHR (0.34) | GAARAB9A | |
| SCHEMBL2980219 | 0.70 | ALDH1A1 (0.36) | CHRM3NPY2R | |
| SCHEMBL2211375 | 0.70 | GPR119 (0.40) | RAB9A |
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-2007130860-A2 | CONSTRAINED COMPOUNDS AS CGRP-RECEPTOR ANTAGONISTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-11-15 | — | — | WO | disclosed |