Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | MMP1 | P03956 | 2/20 | 0.51 |
| ▸ | MMP2 | P08253 | 2/20 | 0.51 |
| ▸ | MMP9 | P14780 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4746745 | 1.00 | ALDH1A1 (0.58) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL4746606 | 0.84 | ALDH1A1 (0.51) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL3240744 | 0.84 | ALDH1A1 (0.55) | ALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL4747913 | 0.83 | RECQL (0.62) | ALDH1A1CYP2C19LMNACYP2C9KMT2A | |
| SCHEMBL17152612 | 0.80 | ALDH1A1 (0.50) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL4749373 | 0.79 | ALDH1A1 (0.49) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL1185095 | 0.77 | ALDH1A1 (0.67) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL7993179 | 0.77 | KMT2A (0.69) | ALDH1A1CYP2D6CYP2C19CYP2C9KMT2A | |
| SCHEMBL13956776 | 0.77 | CYP2C9 (0.71) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 | |
| SCHEMBL2353189 | 0.76 | ALDH1A1 (0.61) | ALDH1A1CYP2D6CYP2C19LMNACYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008119772-A1 | AMIDE DERIVATIVES AS INHIBITORS OF ASPARTYL PROTEASES | MEDIVIR AB (SE) | 2008-10-09 | — | — | WO | disclosed |
| WO-2008107365-A1 | NEW COMPOUNDS | MEDIVIR AB (SE) | 2008-09-12 | — | — | WO | disclosed |