Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MET | P08581 | 5/20 | 0.46 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 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 | |
|---|---|---|---|---|
| SCHEMBL28864863 | 1.00 | ALDH1A1 (0.47) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL20675604 | 0.86 | ALDH1A1 (0.50) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL27988632 | 0.83 | ALDH1A1 (0.47) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL28864791 | 0.83 | ALDH1A1 (0.47) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL29869685 | 0.82 | MET (0.47) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL28864726 | 0.82 | MET (0.47) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL8404544 | 0.78 | ALDH1A1 (0.61) | ALDH1A1PDGFRBPDGFRAHTTCYP1A2 | |
| SCHEMBL31186675 | 0.78 | ALDH1A1 (0.61) | ALDH1A1PDGFRBPDGFRAHTTCYP1A2 | |
| SCHEMBL12410897 | 0.77 | P2RX3 (0.54) | ALDH1A1METPDGFRBPDGFRAHTT | |
| SCHEMBL3344562 | 0.75 | CASP6 (0.62) | ALDH1A1PDGFRBPDGFRAHTTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107312009-B | Quinoline compound, preparation method, intermediate, pharmaceutical composition and application thereof | 上海医药集团股份有限公司 | 2022-09-20 | — | — | CN | disclosed |