Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7964365 | 0.77 | SLC6A2 (0.58) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL21353 | 0.77 | SLC6A2 (0.58) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL809278 | 0.77 | SLC6A2 (0.58) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28366193 | 0.75 | SLC6A2 (0.56) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| Bromide SCHEMBL28597373 | 0.75 | SLC6A2 (0.56) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28101998 | 0.75 | SLC6A2 (0.56) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28366661 | 0.75 | SLC6A2 (0.56) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28101982 | 0.75 | SLC6A2 (0.56) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9810146 | 0.74 | SLC6A2 (0.50) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL24869280 | 0.74 | SLC6A2 (0.61) | SLC6A2TAAR1CYP1A2CYP2C9CYP2C19 |
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-2023281417-A1 | PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS | GLENMARK SPECIALTY S.A. (CH) | 2023-01-12 | — | — | WO | disclosed |