Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28600852 | 0.88 | HTT (0.43) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL28608385 | 0.84 | KDM4E (0.43) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL28612436 | 0.83 | HTT (0.42) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL28599137 | 0.81 | LMNA (0.40) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL28601601 | 0.81 | ALDH1A1 (0.42) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL3731761 | 0.79 | ALDH1A1 (0.54) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL13477486 | 0.79 | TSHR (0.48) | HTTKDM4EGAASMN1; SMN2LMNA | |
| SCHEMBL28612707 | 0.78 | MEN1 (0.41) | HTTKDM4ESMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL28601603 | 0.75 | MAPT (0.50) | KDM4EGAALMNAALDH1A1MAPT | |
| SCHEMBL28604175 | 0.74 | KMT2A (0.48) | KDM4ELMNACYP1A2ALDH1A1HPGD |
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-108558756-B | 2-aryl-2, 3-dihydro-4 (1H) -quinolinone semicarbazone compound and application thereof | 沈阳药科大学 | 2021-08-03 | — | — | CN | claimed |