Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 5/20 | 0.54 |
| ▸ | ACP1 | P24666 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.43 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 2/20 | 0.42 |
| ▸ | TOP1 | P11387 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ESRRB | O95718 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESRRA | P11474 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28619856 | 0.84 | ACHE (0.56) | DHODHTACR3ACHE | |
| SCHEMBL28626532 | 0.82 | DHODH (0.60) | DHODHMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL28622149 | 0.82 | MAPK1 (0.56) | DHODHMEN1KMT2AALDH1A1PLA2G2A | |
| SCHEMBL28626601 | 0.79 | KDM4E (0.64) | DHODHACP1MEN1KMT2AALDH1A1 | |
| SCHEMBL14700162 | 0.78 | DHODH (0.58) | DHODHACP1MEN1KMT2AALDH1A1 | |
| SCHEMBL28349800 | 0.78 | DHODH (0.61) | DHODHACP1MEN1KMT2AALDH1A1 | |
| Hydrochloric Acid SCHEMBL26649609 | 0.77 | DHODH (0.57) | DHODHMEN1KMT2AALDH1A1GAA | |
| SCHEMBL10864863 | 0.75 | DHODH (0.58) | DHODHACP1MEN1KMT2AALDH1A1 | |
| SCHEMBL3625999 | 0.75 | DHODH (0.62) | DHODHACP1MEN1KMT2AALDH1A1 | |
| SCHEMBL13848609 | 0.75 | DHODH (0.52) | DHODHACP1MEN1KMT2AALDH1A1 |
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-113277978-B | Preparation method of 2, 4-disubstituted quinoline compound | 河南师范大学 | 2022-06-03 | — | — | CN | disclosed |
| CN-113277978-A | Preparation method of 2, 4-disubstituted quinoline compound | 河南师范大学 | 2021-08-20 | — | — | CN | disclosed |