Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | DRD4 | P21917 | 4/20 | 0.41 |
| ▸ | DRD3 | P35462 | 4/20 | 0.41 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD5 | P21918 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.38 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 5/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7091144 | 0.82 | DRD2 (0.47) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL96063 | 0.80 | KCNJ1 (0.34) | CRBNNPC1 | |
| SCHEMBL96786 | 0.76 | ALDH1A1 (0.39) | ADRB3ERN1KDM4ENPC1RAB9A | |
| SCHEMBL11625437 | 0.76 | DRD2 (0.46) | DRD2DRD4DRD3DRD1DRD5 | |
| Hydrochloric Acid SCHEMBL11623086 | 0.75 | DRD2 (0.45) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL13074402 | 0.73 | DRD2 (0.51) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL10215352 | 0.72 | ADRB1 (0.50) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL3594555 | 0.71 | SMN1; SMN2 (0.44) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL9651185 | 0.70 | PDE7A (0.42) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL28627769 | 0.70 | ESR2 (0.35) | ERN1TRIM24TRIM33ESR2 |
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-113214153-A | Method for preparing 5-formyl-8-hydroxy-1, 3, 4-trihydroquinoline-2-ketone | 淮北师范大学 | 2021-08-06 | — | — | CN | disclosed |