Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | MAOB | P27338 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | DDX3X | O00571 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30811232 | 0.94 | TSHR (0.51) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL29179989 | 0.94 | TSHR (0.51) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL6313603 | 0.90 | MAOB (0.50) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL31148898 | 0.90 | MAOB (0.50) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL30811231 | 0.88 | GLO1 (0.49) | TSHRMAOBMAOACYP2D6CYP2C9 | |
| SCHEMBL958643 | 0.88 | GLO1 (0.49) | TSHRMAOBMAOACYP2D6CYP2C9 | |
| SCHEMBL2830701 | 0.87 | TSHR (0.57) | TSHRALDH1A1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL15563108 | 0.86 | TSHR (0.53) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL28993586 | 0.86 | CYP2C9 (0.49) | TSHRALDH1A1MAOBMAOACYP2D6 | |
| SCHEMBL28475159 | 0.85 | CYP2D6 (0.46) | TSHRALDH1A1MAOBMAOACYP2D6 |
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-2004096808-A1 | TRIAZINE COMPOUNDS AND THEIR USE | DE NOVO PHARMACEUTICALS LIMITED (GB) | 2004-11-11 | — | — | WO | disclosed |