Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.65 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 6/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 6/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.48 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7832435 | 1.00 | CHRNA7 (0.65) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL7563225 | 1.00 | CHRNA7 (0.65) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL7526106 | 1.00 | CHRNA7 (0.65) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL31204632 | 0.95 | CHRNA7 (0.66) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL6161535 | 0.95 | CHRNA7 (0.66) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL31011774 | 0.91 | CHRNA7 (0.64) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL31011771 | 0.91 | CHRNA7 (0.64) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| Oxalic Acid SCHEMBL7650708 | 0.87 | CHRNA7 (0.60) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| Oxalic Acid SCHEMBL7650711 | 0.87 | CHRNA7 (0.60) | CHRNA7TAAR1OPRM1OPRK1OPRL1 | |
| SCHEMBL12685292 | 0.86 | CHRNA7 (0.55) | CHRNA7TAAR1OPRM1OPRK1OPRL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1192141-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | AstraZeneca UK Limited (GB) | 2002-04-03 | — | — | EP | disclosed |
| EP-1140863-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES USEFUL IN THE TREATMENT OF NEUROLOGICAL DISORDERS | AstraZeneca AB (SE) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000078736-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES AS NEUROPROTECTIVE AGENTS | ASTRAZENECA UK LIMITED (GB) | 2000-12-28 | — | — | WO | disclosed |
| WO-2000039105-A1 | 1,4-DIAZACYCLOHEPTANE DERIVATIVES USEFUL IN THE TREATMENT OF NEUROLOGICAL DISORDERS | ASTRAZENECA AB (SE) | 2000-07-06 | — | — | WO | disclosed |