Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.35 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7044233 | 0.89 | ATM (0.35) | ALDH1A1SMN1; SMN2CTSS | |
| SCHEMBL6467322 | 0.84 | KMT2A (0.33) | ALDH1A1SMN1; SMN2KMT2AHPGDMEN1 | |
| SCHEMBL7466136 | 0.77 | FAAH (0.36) | SMN1; SMN2HTTLMNA | |
| SCHEMBL6466197 | 0.77 | FAAH (0.36) | SMN1; SMN2HTTLMNA | |
| SCHEMBL6063677 | 0.75 | ALOX12 (0.46) | ALDH1A1KMT2ACYP2C19TSHR | |
| SCHEMBL7046552 | 0.74 | ATM (0.33) | SMN1; SMN2CTSS | |
| SCHEMBL6463146 | 0.73 | ATM (0.32) | ALDH1A1SMN1; SMN2CTSS | |
| SCHEMBL7575216 | 0.71 | FAAH (0.36) | SMN1; SMN2HPGDHTTPOLBLMNA | |
| SCHEMBL6467033 | 0.71 | FAAH (0.36) | SMN1; SMN2HPGDHTTPOLBLMNA | |
| SCHEMBL6468396 | 0.71 | LMNA (0.37) | ALDH1A1SMN1; SMN2KMT2AHPGDCYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1516877-A1 | Amine derivatives as protease inhibitors | AXYS PHARMACEUTICALS, INC. (US) | 2005-03-23 | — | — | EP | disclosed |