Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | VCP | P55072 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | MAT2A | P31153 | 2/20 | 0.38 |
| ▸ | PLA2G10 | O15496 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13736633 | 0.79 | ALDH1A1 (0.53) | ALDH1A1TSHRKDM4EHTTPLA2G10 | |
| SCHEMBL1885602 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4EL3MBTL1ATM | |
| SCHEMBL30193576 | 0.75 | KMT2A (0.50) | ALDH1A1KDM4EL3MBTL1HTTKMT2A | |
| SCHEMBL4912683 | 0.75 | KMT2A (0.50) | ALDH1A1KDM4EL3MBTL1HTTKMT2A | |
| SCHEMBL30446730 | 0.75 | ALDH1A1 (0.55) | ALDH1A1TSHRKDM4EL3MBTL1ATM | |
| SCHEMBL14077366 | 0.74 | ALDH1A1 (0.46) | ALDH1A1TSHRKDM4EL3MBTL1ATM | |
| SCHEMBL10324757 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TSHRKDM4EL3MBTL1ATM | |
| SCHEMBL6472453 | 0.73 | SMN1; SMN2 (0.45) | ALDH1A1VCPKDM4EL3MBTL1HTT | |
| SCHEMBL10324756 | 0.73 | ALDH1A1 (0.42) | ALDH1A1TSHRKDM4EL3MBTL1ATM | |
| SCHEMBL16449100 | 0.72 | ALDH1A1 (0.51) | ALDH1A1TSHRKDM4EL3MBTL1ATM |
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 |
|---|---|---|---|---|---|---|---|
| CN-106928121-A | The high efficiency preparation method of 3- substitution-benzo five-membered heterocycle -2- carbonyls | 暨南大学 | 2017-07-07 | — | — | CN | disclosed |