Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | IDO1 | P14902 | 4/20 | 0.41 |
| ▸ | TDO2 | P48775 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1500533 | 0.77 | TSHR (0.50) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL9470689 | 0.77 | LMNA (0.50) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL6190849 | 0.77 | TSHR (0.50) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL17816190 | 0.77 | TSHR (0.50) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL21670832 | 0.77 | TRPV4 (0.35) | — | |
| SCHEMBL15111083 | 0.74 | CYP2A6 (0.47) | MAPK1TDP1CYP2A6CYP19A1SLC6A4 | |
| SCHEMBL21994332 | 0.72 | TSHR (0.46) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL624797 | 0.72 | ADRB2 (0.56) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL16425762 | 0.72 | ADRB2 (0.56) | TSHRHIF1AMAPK1TDP1LMNA | |
| SCHEMBL13205254 | 0.72 | ACHE (0.44) | TSHRTDP1CYP19A1GSK3B |
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-117720460-A | Quinoline compound and preparation method and application thereof | 浙江工业大学 | 2024-03-19 | — | — | CN | claimed |
| CN-117720460-A | Quinoline compound and preparation method and application thereof | 浙江工业大学 | 2024-03-19 | — | — | CN | disclosed |