Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 6/20 | 0.37 |
| ▸ | PPARA | Q07869 | 6/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ACR | P10323 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8376906 | 0.90 | CXCR1 (0.40) | CXCR1CYP2C19CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8375555 | 0.89 | NPC1 (0.35) | CXCR1CYP2C19CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8375770 | 0.88 | CXCR1 (0.43) | CXCR1 | |
| SCHEMBL8378889 | 0.88 | CXCR1 (0.32) | CXCR1LTB4RCYP2C19CYP1A2CYP19A1 | |
| SCHEMBL8379540 | 0.88 | ALDH1A1 (0.38) | CXCR1CYP2C19CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8375559 | 0.88 | CXCR1 (0.41) | EPHX2CXCR1 | |
| SCHEMBL8378946 | 0.88 | CXCR1 (0.40) | EPHX2PPARACXCR1 | |
| SCHEMBL8380142 | 0.87 | HPGD (0.42) | CXCR1CYP2C19CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8374994 | 0.86 | THRB (0.38) | CXCR1CYP2C19CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL8378839 | 0.85 | CXCR1 (0.45) | CXCR1LTB4R |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |