Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OXTR | P30559 | 8/20 | 0.40 |
| ▸ | GRM7 | Q14831 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 2/20 | 0.40 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.40 |
| ▸ | GHSR | Q92847 | 4/20 | 0.38 |
| ▸ | NPY2R | P49146 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19200466 | 0.88 | KDM4D (0.42) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL19182798 | 0.87 | GRM7 (0.39) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL19200482 | 0.87 | GRM7 (0.39) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL19200950 | 0.85 | OXTR (0.37) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL19200481 | 0.79 | GRM7 (0.38) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL19200269 | 0.78 | KDM4D (0.42) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL20678708 | 0.77 | GRM7 (0.50) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL20678709 | 0.77 | GRM7 (0.50) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL20678646 | 0.77 | GRM7 (0.50) | OXTRGRM7CYP3A4AVPR2AVPR1A | |
| SCHEMBL20678643 | 0.77 | GRM7 (0.50) | OXTRGRM7CYP3A4AVPR2AVPR1A |
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-2017131221-A1 | INDANE DERIVATIVES AS MGLUR7 MODULATORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2017-08-03 | — | — | WO | disclosed |