Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.33 |
| ▸ | HTR3B | O95264 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR1E | P28566 | 1/20 | 0.33 |
| ▸ | HTR1F | P30939 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.33 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29020313 | 0.78 | ALDH1A1 (0.44) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL16901817 | 0.77 | ALDH1A1 (0.40) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL1418985 | 0.74 | ALDH1A1 (0.47) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL12664443 | 0.74 | ALDH1A1 (0.41) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL10130976 | 0.73 | ALDH1A1 (0.42) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL10684074 | 0.72 | ALDH1A1 (0.49) | ALDH1A1ADRA1DADRA1AADRA1B | |
| SCHEMBL8701373 | 0.71 | ALDH1A1 (0.38) | ALDH1A1ADRA1DADRA1AADRA1BHTR1A | |
| SCHEMBL3229983 | 0.71 | ALDH1A1 (0.39) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL30762031 | 0.71 | ALDH1A1 (0.39) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 | |
| SCHEMBL16901827 | 0.70 | ALDH1A1 (0.47) | ALDH1A1ADRA1DADRA1AADRA1BDPP4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5750530-A | PLASMINOGEN ACTIVATOR INHIBITORS | XENOVA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |
| EP-0760812-A1 | PHARMACEUTICAL DIKETOPIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1997-03-12 | — | — | EP | disclosed |
| WO-1995032190-A2 | PHARMACEUTICAL DIKETOPIPERAZINE COMPOUNDS | XENOVA LIMITED (GB) | 1995-11-30 | — | — | WO | disclosed |