Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HBB | P68871 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.34 |
| ▸ | TSPO | P30536 | 2/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 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 | |
|---|---|---|---|---|
| SCHEMBL23052976 | 0.95 | ALDH1A1 (0.42) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL12559383 | 0.83 | GPR3 (0.55) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL12249804 | 0.83 | GPR3 (0.55) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL17265852 | 0.83 | KDM4E (0.38) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL18388620 | 0.83 | KDM4E (0.42) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL20005872 | 0.83 | TSPO (0.39) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL76676 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL23352493 | 0.81 | KDM4E (0.60) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL13301595 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1MAPTL3MBTL1TDP1 | |
| SCHEMBL10042885 | 0.81 | KDM4E (0.60) | KDM4EALDH1A1MAPTL3MBTL1TDP1 |
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-2021036978-A1 | TETRADENTATE LIGANDS, GOLD(III) COMPLEXES, PREPARATION METHOD AND USE THEREOF | CHE CHI MING (CN) | 2021-03-04 | — | — | WO | disclosed |