Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 2/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9025658 | 0.86 | IDO1 (0.38) | SLC6A3LMNAKDM4EACHE | |
| SCHEMBL8630297 | 0.85 | PFKFB3 (0.38) | SLC6A3TSHRKDM4EPFKFB3 | |
| SCHEMBL8634093 | 0.84 | BRD4 (0.43) | BRD4ACHECREBBP | |
| SCHEMBL8631276 | 0.84 | BRD4 (0.41) | ADRB1SLC6A3ADRB2ADRB3BRD4 | |
| SCHEMBL2593085 | 0.82 | SLC6A3 (0.44) | SLC6A3LMNAKDM4EBRD4CREBBP | |
| SCHEMBL8631320 | 0.81 | ALDH1A1 (0.37) | SLC6A3TSHRRAB9ALMNAKDM4E | |
| SCHEMBL8656491 | 0.81 | TP53 (0.40) | SLC6A3BRD4CREBBP | |
| SCHEMBL8629437 | 0.81 | BRD4 (0.45) | TSHRBRD4ACHECREBBP | |
| SCHEMBL9026792 | 0.80 | KMT2A (0.48) | — | |
| SCHEMBL8629582 | 0.78 | KMT2A (0.46) | SLC6A3TSHRLMNAKDM4EPFKFB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5712299-A | TREATMENT OF NEURODEGENERATIVE DISORDERS | ASTRA AKTIEBOLAG (SE) | 1998-01-27 | — | — | US | disclosed |