Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.37 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.37 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | AGXT | P21549 | 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 | |
|---|---|---|---|---|
| SCHEMBL4693009 | 0.78 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL28306258 | 0.74 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL4693015 | 0.74 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL27622597 | 0.74 | SLC6A2 (0.47) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL22799554 | 0.73 | CYP2C9 (0.44) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL7011964 | 0.72 | TSHR (0.48) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL872358 | 0.72 | TSHR (0.48) | SLC6A2SLC6A4SLC6A3TSHRSLC1A3 | |
| SCHEMBL10971393 | 0.72 | IDO1 (0.41) | SLC6A2SLC6A4SLC6A3CYP2C9CYP2C19 | |
| SCHEMBL1355000 | 0.70 | SLC6A4 (0.44) | SLC6A2SLC6A4SLC6A3CYP2C9CYP2C19 | |
| SCHEMBL11372657 | 0.70 | CYP2C19 (0.50) | SLC6A2SLC6A3TSHRCYP2C9CYP2C19 |
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-2010127212-A1 | INHIBITORS OF ACETYL-COA CARBOXYLASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-11-04 | — | — | WO | disclosed |