Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 3/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | DRD3 | P35462 | 2/20 | 0.34 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL21274397 | 0.90 | HTR1A (0.37) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21281500 | 0.85 | ADRA1A (0.45) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21273954 | 0.84 | PARP1 (0.45) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| Ammonia Solution, Strong SCHEMBL28505508 | 0.81 | ADRA1B (0.35) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21268787 | 0.81 | PARP1 (0.42) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21285495 | 0.81 | PARP1 (0.42) | ADRA1BPARP1ADRA1AADRA1DALDH1A1 | |
| SCHEMBL21274394 | 0.80 | NPC1 (0.37) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| Formamide SCHEMBL21274109 | 0.79 | PARP1 (0.36) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21273937 | 0.78 | ADRA1A (0.37) | ADRA1BHTR1APARP1ADRA1AADRA1D | |
| SCHEMBL21281469 | 0.78 | DRD2 (0.39) | ADRA1BPARP1ADRA1AADRA1DDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019158731-A1 | PHARMACEUTICAL 6,5 HETEROBICYCLIC RING DERIVATIVES | UCB BIOPHARMA SPRL (BE) | 2019-08-22 | — | — | WO | disclosed |