Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | GALR3 | O60755 | 1/20 | 0.37 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177639 | 1.00 | GRM2 (0.44) | GRM2MAPTBRD4DPP4DPP7 | |
| SCHEMBL20177500 | 0.79 | DPP4 (0.43) | GRM2MAPTDPP4DPP7ALDH1A1 | |
| SCHEMBL20177495 | 0.69 | USP2 (0.40) | GRM2MAPTGALR3NR2F2ALDH1A1 | |
| SCHEMBL20177558 | 0.68 | GRM2 (0.45) | GRM2MAPTDPP4DPP7ALDH1A1 | |
| SCHEMBL20177891 | 0.67 | BRD4 (0.48) | MAPTBRD4ALDH1A1ADRA1DADRA1A | |
| SCHEMBL20177662 | 0.67 | BRD4 (0.48) | MAPTBRD4ALDH1A1ADRA1DADRA1A | |
| SCHEMBL29941288 | 0.64 | ALDH1A1 (0.40) | GRM2DPP4DPP7ALDH1A1TSHR | |
| SCHEMBL7924287 | 0.63 | DPP4 (0.38) | GRM2DPP4DPP7ALDH1A1MEN1 | |
| SCHEMBL5745617 | 0.62 | TSHR (0.44) | GRM2ALDH1A1TSHRNPC1RAB9A | |
| SCHEMBL8355374 | 0.62 | GRM2 (0.50) | GRM2ALDH1A1TSHRMEN1KMT2A |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |