Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSB | P07858 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL410895 | 0.83 | ALDH1A1 (0.46) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL1168211 | 0.83 | ALDH1A1 (0.40) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL618379 | 0.82 | ALDH1A1 (0.40) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL6525954 | 0.80 | NPC1 (0.39) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL1169106 | 0.79 | KMT2A (0.39) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL617582 | 0.79 | PTGS2 (0.40) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL10189635 | 0.75 | ALDH1A1 (0.40) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL14619167 | 0.74 | MAPT (0.51) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL10189784 | 0.70 | ALDH1A1 (0.33) | ALDH1A1KMT2AMAPTKDM4EMEN1 | |
| SCHEMBL31237366 | 0.67 | ALDH1A1 (0.60) | ALDH1A1KMT2AMAPTKDM4EMEN1 |
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-1919881-B1 | 1, 2, 3 -TRIAZOLES INHIBITORS OF TUBULIN POLYMERIZATION FOR THE TREATMENT OF POLIFERATIVE DISORDERS | SYNTA PHARMACEUTICALS CORP (US) | 2013-04-10 | — | — | EP | disclosed |