Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL7523498 | 1.00 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7523506 | 1.00 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7523503 | 1.00 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3680204 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7527097 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL2826921 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7522233 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3674735 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL3676137 | 0.95 | CYP3A4 (0.39) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 | |
| Carbon Monoxide SCHEMBL11122540 | 0.91 | CHRNB2 (0.33) | CYP3A4TDP1CHRNB2CHRNB4CHRNA3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0117156-A1 | Process for the production of trans-1,2-(dihalophosphino) cycloalkanes | The British Petroleum Company p.l.c. (GB) | 1984-08-29 | — | — | EP | claimed |
| WO-1984003283-A1 | PROCESS FOR THE PRODUCTION OF TRANS-1,2-(DIHALOPHOSPHINO)CYCLOALKANES | BRITISH PETROLEUM CO PLC (GB) | 1984-08-30 | — | — | WO | disclosed |
| EP-0117156-A1 | Process for the production of trans-1,2-(dihalophosphino) cycloalkanes | The British Petroleum Company p.l.c. (GB) | 1984-08-29 | — | — | EP | disclosed |