Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | DCAF1 | Q9Y4B6 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5224724 | 0.79 | KMT2A (0.38) | KMT2AALDH1A1MAPTL3MBTL1CYP17A1 | |
| SCHEMBL5226627 | 0.78 | KMT2A (0.40) | KMT2AALDH1A1MAPTL3MBTL1KDM4E | |
| SCHEMBL5224311 | 0.76 | LMNA (0.45) | KMT2AALDH1A1MAPTL3MBTL1TSHR | |
| SCHEMBL5232268 | 0.73 | BCL2L11 (0.39) | KMT2AALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL5230462 | 0.73 | HTR1A (0.47) | KMT2AALDH1A1MAPTKDM4EHPGD | |
| SCHEMBL5229009 | 0.69 | KMT2A (0.34) | KMT2AALDH1A1MAPTL3MBTL1KDM4E | |
| SCHEMBL5226495 | 0.69 | NPSR1 (0.44) | KMT2AALDH1A1MAPTKDM4ETSHR | |
| SCHEMBL2901811 | 0.68 | AKT1 (0.39) | KMT2AALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5225666 | 0.65 | NPBWR1 (0.43) | ALDH1A1MAPTKDM4EHPGDTSHR | |
| SCHEMBL2761238 | 0.64 | LMNA (0.51) | KMT2AALDH1A1CYP1A2CYP3A4CYP2D6 |
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-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |