Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 4/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.40 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28599130 | 0.94 | AR (0.44) | ARALDH1A1GRIK1KDRP2RX1 | |
| SCHEMBL28601601 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KDRKDM4ELMNACYP1A2 | |
| SCHEMBL28599137 | 0.88 | LMNA (0.40) | ALDH1A1GRIK1KDRKDM4ELMNA | |
| SCHEMBL28608373 | 0.87 | PARP1 (0.46) | ARALDH1A1GRIK1KDRFPR2 | |
| SCHEMBL28612436 | 0.87 | HTT (0.42) | ALDH1A1KDRKDM4ELMNACYP1A2 | |
| SCHEMBL28612707 | 0.86 | MEN1 (0.41) | ALDH1A1GRIK1FPR2KDM4ECYP2C9 | |
| SCHEMBL28618559 | 0.85 | MEN1 (0.41) | ARKDRKDM4ELMNACYP1A2 | |
| SCHEMBL28608385 | 0.84 | KDM4E (0.43) | ALDH1A1KDRKDM4ELMNACYP1A2 | |
| Aza-Flavanone SCHEMBL28603916 | 0.84 | PARP1 (0.47) | ALDH1A1KDRFPR2LMNA | |
| SCHEMBL28604163 | 0.83 | GRIK1 (0.43) | ARALDH1A1GRIK1KDRP2RX1 |
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 |