Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 1.00 |
| ▸ | DRD2 | P14416 | 2/20 | 1.00 |
| ▸ | ADRA2B | P18089 | 1/20 | 1.00 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 1.00 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5674428 | 1.00 | ADRA2A (1.00) | ADRA2ADRD2ADRA2BSIGMAR1HTR2C | |
| SCHEMBL29468692 | 1.00 | ADRA2A (1.00) | ADRA2ADRD2ADRA2BSIGMAR1HTR2C | |
| SCHEMBL8319492 | 0.88 | DRD2 (0.78) | ADRA2ADRD2ADRA2BSIGMAR1HTR2C | |
| SCHEMBL8326105 | 0.88 | DRD2 (0.78) | ADRA2ADRD2ADRA2BSIGMAR1RAB9A | |
| SCHEMBL8325505 | 0.85 | DRD2 (0.74) | ADRA2ADRD2ADRA2BSIGMAR1MEN1 | |
| SCHEMBL8320289 | 0.84 | DRD2 (0.73) | ADRA2ADRD2ADRA2BSIGMAR1MAPT | |
| SCHEMBL8321611 | 0.84 | DRD2 (0.72) | ADRA2ADRD2ADRA2BSIGMAR1 | |
| SCHEMBL8319263 | 0.81 | DRD2 (0.68) | ADRA2ADRD2ADRA2BSIGMAR1MAPT | |
| SCHEMBL8323168 | 0.78 | CYP3A4 (0.65) | ADRA2ADRD2ADRA2BSIGMAR1HTR2C | |
| SCHEMBL8324313 | 0.78 | DRD2 (0.64) | ADRA2ADRD2ADRA2BSIGMAR1HTR7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1056720-B1 | PHTALIMIDO ARYLPIPERAZINES AS ALPHA 1A RECEPTOR ANTAGONISTS USEFUL IN THE TREATMENT OF BENIGN PROSTATIC HYPERPLASIA | ORTHO MCNEIL PHARM INC (US) | 2004-10-20 | — | — | EP | disclosed |