Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL7678337 | 1.00 | CHRNA7 (0.60) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL7687240 | 1.00 | CHRNA7 (0.60) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL7680070 | 0.83 | CHRNA7 (0.67) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL7678292 | 0.83 | CHRNA7 (0.67) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL7680425 | 0.83 | CHRNA7 (0.67) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL20137193 | 0.82 | CHRNA7 (0.80) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL5899579 | 0.82 | CHRNA7 (0.80) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL7663736 | 0.81 | HCRTR1 (0.49) | CHRNA7 | |
| SCHEMBL6001969 | 0.81 | CHRNA7 (0.68) | CHRNA7OPRM1OPRK1OPRL1HTR2C | |
| SCHEMBL9737757 | 0.81 | CHRNA7 (0.77) | CHRNA7OPRM1OPRK1OPRL1HTR2C |
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-6417183-B1 | DRUGS RELATES TO 1,4-DIAZACYCLOHEPTANES, TO PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND TO THEIR USE IN METHODS OF THERAPEUTIC TREATMENT OF NERVOUS SYSTEM DISORDERS | ASTRAZENELA UK LIMITED (GB) | 2002-07-09 | — | — | US | claimed |
| EP-1060169-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES | AstraZeneca AB (SE) | 2000-12-20 | — | — | EP | claimed |
| WO-1999032461-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES | ASTRAZENECA UK LIMITED (GB) | 1999-07-01 | — | — | WO | claimed |