Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16398483 | 1.00 | GRIN2B (0.43) | GRIN2BCYP19A1MAOAMEN1KMT2A | |
| SCHEMBL16403669 | 0.90 | GRIN2B (0.41) | GRIN2BCYP19A1MAOASIGMAR1 | |
| SCHEMBL16403670 | 0.90 | GRIN2B (0.41) | GRIN2BCYP19A1MAOASIGMAR1 | |
| SCHEMBL6516432 | 0.87 | SLC18A2 (0.43) | — | |
| SCHEMBL16398748 | 0.85 | SLC18A3 (0.40) | GRIN2BMEN1KMT2AGRIN1SIGMAR1 | |
| SCHEMBL16398747 | 0.85 | SLC18A3 (0.40) | GRIN2BMEN1KMT2AGRIN1SIGMAR1 | |
| SCHEMBL16398750 | 0.77 | SLC18A2 (0.45) | — | |
| SCHEMBL16398752 | 0.77 | SLC18A2 (0.45) | — | |
| SCHEMBL1200566 | 0.76 | GBA1 (0.42) | — | |
| SCHEMBL25062342 | 0.73 | TSHR (0.44) | MEN1KMT2ATDP1 |
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-2015008097-A1 | ASYMMETRIC SYNTHESIS OF CHIRAL COMPOUNDS | ISIS INNOVATION LIMITED (GB) | 2015-01-22 | — | — | WO | disclosed |