Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | KHK | P50053 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 1/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 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 | |
|---|---|---|---|---|
| SCHEMBL4560014 | 0.74 | PLD1 (0.46) | ALDH1A1PLD1SLC6A4KMT2A | |
| SCHEMBL8409477 | 0.72 | PDE5A (0.38) | ALDH1A1PLD1SLC6A4ADRA1DADRA1A | |
| SCHEMBL3334093 | 0.71 | EPHX2 (0.51) | PLD1PARP1FLT3TYRO3MERTK | |
| Water SCHEMBL8415043 | 0.70 | EPHX2 (0.50) | PLD1PARP1FLT3TYRO3MERTK | |
| Hydrochloric Acid SCHEMBL8703350 | 0.70 | EPHX2 (0.50) | ALDH1A1PARP1FLT3TYRO3MERTK | |
| Hydrochloric Acid SCHEMBL9076651 | 0.69 | PARP1 (0.49) | ALDH1A1PARP1FLT3TYRO3MERTK | |
| SCHEMBL8406794 | 0.69 | SLC6A2 (0.40) | IDO1SLC6A4GRM5ADRA1DADRA1A | |
| Propionic Acid SCHEMBL9640910 | 0.68 | PARP1 (0.53) | HTR6ALDH1A1MAPTPARP1 | |
| SCHEMBL8409833 | 0.68 | KHK (0.37) | IDO1GRM5ADRA1DADRA1AADRA1B | |
| SCHEMBL10606573 | 0.67 | IDO1 (0.47) | IDO1ALDH1A1MAPTGRM5ALOX15 |
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-1128139-C | Novel piperazine derivative and process for producing the same | SAMJIN PHARM CO LTD (KR) | 2003-11-19 | — | — | CN | disclosed |
| CN-1145620-A | New piperazine derivatives and its prepn. | SAMJIN PHARM CO LTD (KR) | 1997-03-19 | — | — | CN | disclosed |