Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 3/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1427504 | 1.00 | ALDH1A1 (0.42) | ALDH1A1LTA4HKDM4EHPGDTDP1 | |
| SCHEMBL16215682 | 0.83 | ALDH1A1 (0.52) | ALDH1A1LTA4HL3MBTL1ACHEHRH3 | |
| SCHEMBL17533290 | 0.83 | ALDH1A1 (0.44) | ALDH1A1LTA4HKDM4EACHEHRH3 | |
| SCHEMBL13405849 | 0.83 | ALDH1A1 (0.50) | ALDH1A1LTA4HKDM4EHPGDACHE | |
| SCHEMBL3146950 | 0.81 | ALDH1A1 (0.63) | ALDH1A1LTA4HKDM4ETDP1ACHE | |
| SCHEMBL17055247 | 0.81 | LTA4H (0.54) | ALDH1A1LTA4HKDM4EHPGDACHE | |
| SCHEMBL18557 | 0.81 | LTA4H (0.54) | ALDH1A1LTA4HKDM4EHPGDACHE | |
| SCHEMBL12499953 | 0.80 | KDM4E (0.40) | ALDH1A1KDM4EL3MBTL1ACHEHRH3 | |
| SCHEMBL12499770 | 0.80 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDSIGMAR1POLB | |
| SCHEMBL12463216 | 0.80 | OPRK1 (0.45) | ALDH1A1L3MBTL1SIGMAR1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116964046-B | PLK4 inhibitors and uses thereof | 上海齐鲁制药研究中心有限公司 | 2024-04-19 | — | — | CN | disclosed |
| CN-116964046-A | PLK4 inhibitors and uses thereof | 上海齐鲁制药研究中心有限公司 | 2023-10-27 | — | — | CN | disclosed |
| WO-2022184049-A1 | PLK4 INHIBITOR AND USE THEREOF | 上海齐鲁制药研究中心有限公司 | 2022-09-09 | — | — | WO | disclosed |