Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 9/20 | 0.54 |
| ▸ | HTR2A | P28223 | 7/20 | 0.54 |
| ▸ | HTR1A | P08908 | 6/20 | 0.54 |
| ▸ | HTR7 | P34969 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.53 |
| ▸ | RELA | Q04206 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 6/20 | 0.49 |
| ▸ | DRD1 | P21728 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28612645 | 1.00 | DRD2 (0.54) | DRD2HTR2AHTR1AHTR7NPC1 | |
| SCHEMBL28616498 | 0.87 | HTR1A (0.58) | DRD2HTR2AHTR1AHTR7DRD3 | |
| SCHEMBL29995988 | 0.81 | POLB (0.52) | NPC1NFKB1RAB9ANFKB2RELA | |
| SCHEMBL28626681 | 0.81 | POLB (0.52) | NPC1NFKB1RAB9ANFKB2RELA | |
| SCHEMBL28614770 | 0.81 | DRD2 (0.54) | DRD2HTR2AHTR1AHTR7DRD3 | |
| SCHEMBL29675216 | 0.81 | DRD2 (0.54) | DRD2HTR2AHTR1AHTR7DRD3 | |
| SCHEMBL28612617 | 0.79 | NPC1 (0.51) | DRD2HTR2AHTR1AHTR7NPC1 | |
| SCHEMBL29675679 | 0.79 | NPC1 (0.51) | DRD2HTR2AHTR1AHTR7NPC1 | |
| SCHEMBL28735817 | 0.75 | DRD2 (0.44) | DRD2HTR2AHTR1AHTR7DRD3 | |
| SCHEMBL29675288 | 0.75 | DRD2 (0.44) | DRD2HTR2AHTR1AHTR7DRD3 |
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-113292515-B | Urea compound containing piperazine group and preparation method and application thereof | 沈阳药科大学 | 2022-05-20 | — | — | CN | disclosed |