Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 2/20 | 0.66 |
| ▸ | ACACA | Q13085 | 4/20 | 0.65 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.61 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.54 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | DHODH | Q02127 | 2/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7611160 | 1.00 | TOP1 (0.66) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL28251705 | 1.00 | TOP1 (0.66) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL8657096 | 0.98 | TOP1 (0.63) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL31592763 | 0.93 | GRM2 (0.60) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL670148 | 0.93 | GRM2 (0.60) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL4594838 | 0.91 | ACACA (0.75) | TOP1ACACAKDM4ETDP1HPGD | |
| SCHEMBL6660719 | 0.90 | TOP1 (0.58) | TOP1ACACACYP19A1GRM2KDM4E | |
| SCHEMBL4607752 | 0.89 | ACACA (0.73) | TOP1ACACAKDM4ETDP1HPGD | |
| SCHEMBL29399315 | 0.89 | ACACA (0.72) | TOP1ACACAKDM4ETDP1HPGD | |
| SCHEMBL1042853 | 0.89 | ACACA (0.72) | TOP1ACACAKDM4ETDP1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118459402-A | Preparation method of quinoline derivative synthesized by palladium-zirconium bimetallic series catalysis | 延安大学 | 2024-08-09 | — | — | CN | disclosed |
| CN-110156673-B | Method for preparing quinoline compound by catalysis of zirconocene dichloride | 陕西师范大学 | 2022-02-25 | — | — | CN | disclosed |