Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 5/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CCR2 | P41597 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.40 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19986657 | 0.92 | CCR1 (0.43) | KMT2AALDH1A1MAPTMEN1L3MBTL1 | |
| SCHEMBL19986534 | 0.88 | ALDH1A1 (0.46) | KMT2AALDH1A1MAPTMEN1MAPK1 | |
| SCHEMBL19986538 | 0.81 | KMT2A (0.60) | KMT2AALDH1A1MAPTMEN1CYP3A4 | |
| SCHEMBL19986706 | 0.81 | HTR2A (0.44) | KMT2AALDH1A1MAPTMEN1PKM | |
| SCHEMBL28577778 | 0.76 | CYP3A4 (0.46) | KMT2AALDH1A1MAPTMEN1MAPK1 | |
| SCHEMBL5320613 | 0.74 | KMT2A (0.51) | KMT2AALDH1A1MAPTMEN1L3MBTL1 | |
| SCHEMBL10781482 | 0.71 | ALDH1A1 (0.57) | KMT2AALDH1A1MAPTMEN1L3MBTL1 | |
| SCHEMBL19986473 | 0.70 | KMT2A (0.48) | KMT2AALDH1A1MAPTMEN1PKM | |
| SCHEMBL28588269 | 0.70 | CA1 (0.40) | KMT2AMEN1L3MBTL1CYP3A4CYP2C9 | |
| SCHEMBL19986468 | 0.70 | MEN1 (0.44) | KMT2AALDH1A1MAPTMEN1PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |