Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | GLRA1 | P23415 | 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 | |
|---|---|---|---|---|
| SCHEMBL4726434 | 1.00 | SLC6A9 (0.57) | SLC6A9MAPK1ADORA2AADORA1CYP3A4 | |
| SCHEMBL4726432 | 1.00 | SLC6A9 (0.57) | SLC6A9MAPK1ADORA2AADORA1CYP3A4 | |
| Hydrochloric Acid SCHEMBL4776232 | 0.99 | SLC6A9 (0.56) | SLC6A9MAPK1KCNH2 | |
| Hydrochloric Acid SCHEMBL4776228 | 0.99 | SLC6A9 (0.56) | SLC6A9MAPK1KCNH2 | |
| Hydrochloric Acid SCHEMBL4776231 | 0.99 | SLC6A9 (0.56) | SLC6A9MAPK1KCNH2 | |
| SCHEMBL4775946 | 0.94 | SLC6A9 (0.56) | SLC6A9MAPK1 | |
| SCHEMBL4775949 | 0.94 | SLC6A9 (0.56) | SLC6A9MAPK1 | |
| SCHEMBL4775947 | 0.94 | SLC6A9 (0.56) | SLC6A9MAPK1 | |
| Hydrochloric Acid SCHEMBL4776025 | 0.94 | SLC6A9 (0.55) | SLC6A9MAPK1 | |
| Hydrochloric Acid SCHEMBL4776026 | 0.94 | SLC6A9 (0.55) | SLC6A9MAPK1 |
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-2008018639-A2 | GLYCINE TRANSPORTER INHIBITOR | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2008-02-14 | — | — | WO | disclosed |