Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758751 | 0.71 | CYP2C19 (0.40) | CYP2C19SMN1; SMN2L3MBTL1ALDH1A1HPGD | |
| SCHEMBL6125635 | 0.69 | CYP2C19 (0.51) | CYP2C19SMN1; SMN2CYP2D6SLC6A3 | |
| SCHEMBL1458049 | 0.69 | CYP2C19 (0.51) | CYP2C19SMN1; SMN2CYP2D6SLC6A3 | |
| SCHEMBL1458053 | 0.69 | CYP2C19 (0.51) | CYP2C19SMN1; SMN2CYP2D6SLC6A3 | |
| SCHEMBL28678702 | 0.67 | CYP2C19 (0.45) | CYP2C19SMN1; SMN2ALDH1A1KMT2ACYP1A2 | |
| SCHEMBL10584727 | 0.67 | EPHX1 (0.54) | CYP2C19SMN1; SMN2CYP1A2CYP2D6SLC6A3 | |
| Lithium Ion SCHEMBL1458160 | 0.66 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| Lithium Ion SCHEMBL1457968 | 0.66 | CYP2C19 (0.44) | CYP2C19SMN1; SMN2ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL7556318 | 0.63 | CYP2C19 (0.38) | CYP2C19SMN1; SMN2HPGDCYP1A2CYP3A4 | |
| SCHEMBL7070422 | 0.62 | CYP2C19 (0.52) | CYP2C19SMN1; SMN2L3MBTL1ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5158956-A | Administering serotonin receptor agonist | ELI LILLY AND COMPANY (US) | 1992-10-27 | — | — | US | disclosed |