Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | STAT6 | P42226 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | DPP4 | P27487 | 3/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | MTHFD2 | P13995 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL13938272 | 0.88 | MAOB (0.54) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MAOB | |
| SCHEMBL13939669 | 0.86 | DPP4 (0.52) | LMNAALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL13939299 | 0.85 | MAOB (0.55) | SMN1; SMN2CYP3A4CYP2C9CYP2C19MAOB | |
| SCHEMBL13939665 | 0.85 | DPP4 (0.51) | LMNAALDH1A1TSHRNPSR1HPGD | |
| SCHEMBL13939679 | 0.83 | PCSK9 (0.56) | SMN1; SMN2CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL13939683 | 0.81 | PCSK9 (0.55) | SMN1; SMN2MAOBLMNAALDH1A1TSHR | |
| SCHEMBL12604427 | 0.81 | SMN1; SMN2 (0.72) | SMN1; SMN2CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13939684 | 0.81 | ALDH1A1 (0.53) | SMN1; SMN2CYP3A4CYP2C9CYP2C19LMNA | |
| SCHEMBL13939497 | 0.80 | SMN1; SMN2 (0.71) | SMN1; SMN2CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13939514 | 0.79 | DPP4 (0.49) | SMN1; SMN2LMNAALDH1A1TSHRNPSR1 |
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-7495004-B2 | Purine derivatives as liver X receptor agonists | GLAXO GROUP LIMITED (GB) | 2009-02-24 | — | — | US | disclosed |