Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.58 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.58 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.58 |
| ▸ | HSD11B1 | P28845 | 4/20 | 0.56 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.48 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | HSD11B2 | P80365 | 1/20 | 0.38 |
| ▸ | CCR5 | P51681 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6674224 | 1.00 | CHRNB2 (0.58) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL6674226 | 1.00 | CHRNB2 (0.58) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL11204341 | 0.98 | HSD11B1 (0.59) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL11204345 | 0.98 | HSD11B1 (0.59) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL11201571 | 0.95 | CHRNB2 (0.58) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL1569444 | 0.95 | CHRNB2 (0.58) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL20343709 | 0.95 | CHRNB2 (0.58) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL18711710 | 0.87 | HSD11B1 (0.53) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL18478535 | 0.87 | HSD11B1 (0.53) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 | |
| SCHEMBL879232 | 0.87 | HSD11B1 (0.53) | CHRNB2CHRNA3CHRNA4CHRNB4HSD11B1 |
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-0899259-B1 | Process for the preparation of cis-hexahydroisoindolines | YUKI GOSEI YAKUHIN KOGYO KK (JP) | 2004-10-13 | — | — | EP | disclosed |
| US-5932744-A | Process for the preparation of cis-hexahydroisoindoline derivatives | YUKI GOSEI KOGYO CO., LTD. (JP) | 1999-08-03 | — | — | US | disclosed |
| EP-0899259-A1 | Process for the preparation of cis-hexahydroisoindolines | YUKI GOSEI KOGYO CO., LTD. (JP) | 1999-03-03 | — | — | EP | disclosed |