Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | TERT | O14746 | 1/20 | 0.37 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.37 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.34 |
| ▸ | MOK | Q9UQ07 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.32 |
| ▸ | CKS1B | P61024 | 1/20 | 0.32 |
| ▸ | SKP1 | P63208 | 1/20 | 0.32 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20838489 | 1.00 | TMEM97 (0.40) | TMEM97SIGMAR1TERTKCNQ4KCNQ5 | |
| SCHEMBL20838468 | 0.82 | MAPKAPK2 (0.34) | TMEM97SIGMAR1TERTATMMOK | |
| SCHEMBL20853406 | 0.80 | LCK (0.37) | SIGMAR1TERTATMMAPKAPK2CKS1B | |
| SCHEMBL20853401 | 0.77 | CYP17A1 (0.40) | KCNQ4KCNQ5CYP17A1BRAF | |
| SCHEMBL30711774 | 0.77 | CYP17A1 (0.40) | KCNQ4KCNQ5CYP17A1BRAF | |
| SCHEMBL20838488 | 0.76 | TERT (0.38) | TMEM97SIGMAR1TERTMAP4K4MOK | |
| SCHEMBL20838475 | 0.76 | MOK (0.39) | TMEM97SIGMAR1TERTMOKTACR1 | |
| SCHEMBL20882035 | 0.76 | CYP17A1 (0.38) | KCNQ4KCNQ5CYP17A1BRAFMAPKAPK2 | |
| SCHEMBL30711791 | 0.76 | CYP17A1 (0.38) | KCNQ4KCNQ5CYP17A1BRAFMAPKAPK2 | |
| SCHEMBL1507944 | 0.74 | PLAU (0.43) | — |
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-3466931-B1 | TETRADENTATE CHELATING MONOQUINOLINE DERIVATIVE, MANUFACTURING METHOD THEREOF, AND APPLICATION OF SAME AS METAL ION REGULATOR FOR NEURODEGENERATIVE DISEASE | UNIV GUANGDONG TECHNOLOGY (CN) | 2024-01-10 | — | — | EP | disclosed |