Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.60 |
| ▸ | HTR1A | P08908 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | HTR2C | P28335 | 3/20 | 0.49 |
| ▸ | HTR7 | P34969 | 3/20 | 0.49 |
| ▸ | HTR6 | P50406 | 3/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7731108 | 0.84 | CYP2C9 (0.50) | DRD2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| SCHEMBL7731671 | 0.81 | SIGMAR1 (0.59) | HTR2AHTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7734158 | 0.80 | HTR1A (0.52) | HTR2AHTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7732468 | 0.80 | HTR1A (0.52) | HTR2AHTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL7839803 | 0.76 | HTR2A (1.00) | HTR2AKCNH2HTR2CHTR7HTR6 | |
| SCHEMBL7734202 | 0.75 | CYP2D6 (0.52) | DRD2CYP2C9CYP2C19CYP2D6CYP1A2 | |
| Hydrochloric Acid SCHEMBL7828801 | 0.75 | HTR2A (0.97) | HTR2AKCNH2HTR2CHTR7HTR6 | |
| SCHEMBL9172271 | 0.73 | HTR2A (0.82) | HTR2AKCNH2HTR2CHTR7HTR6 | |
| SCHEMBL7839501 | 0.72 | HTR2A (0.60) | HTR2AHTR1ASLC6A2SLC6A4DRD2 | |
| SCHEMBL8948027 | 0.71 | HTR1A (0.57) | HTR2AHTR1AKCNH2HTR2CCYP2D6 |
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-6407122-B1 | NEUROPROTECTIVE AGENTS, ANTIISCHEMIC, AND HYPERGLYCEMIC AGENTS; HUNTINGTON*S, PARKINSON*S, AND ALZHEIMER*S DISEASE;AMYOTROPHIC LATERAL SCLEROSIS TREATMENT; NERVOUS SYSTEM AND BRAIN DISORDERS | PHARMACIA & UPJOHN S.P.A. (IT) | 2002-06-18 | — | — | US | disclosed |
| EP-1037890-A1 | AMINO-BENZOTHIAZOLE DERIVATIVES | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-09-27 | — | — | EP | disclosed |
| WO-1999028318-A1 | AMINO-BENZOTHIAZOLE DERIVATIVES | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-06-10 | — | — | WO | disclosed |