Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.48 |
| ▸ | ITGAV | P06756 | 1/20 | 0.48 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.48 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.45 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.44 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL20858858 | 0.84 | ITGB1 (0.67) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL19474987 | 0.84 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL19474986 | 0.84 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL1308046 | 0.82 | RAB9A (0.58) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL1307699 | 0.82 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL11086218 | 0.82 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL1309116 | 0.82 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL8855650 | 0.81 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2CA2ITGB3ITGB1 | |
| SCHEMBL2504314 | 0.80 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2CA2 | |
| SCHEMBL5741372 | 0.80 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2CA2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2242364-A1 | PREPARATION AND ENANTIOMERIC SEPARATION OF 7-(3-PYRIDINYL)-1,7-DIAZASPIROÝ4.4¨NONANE AND NOVEL SALT FORMS OF THE RACEMATE AND ENANTIOMERS | Targacept Inc. (US) | 2010-10-27 | — | — | EP | disclosed |
| WO-2009091561-A1 | PREPARATION AND ENANTIOMERIC SEPARATION OF 7-(3-PYRIDINYL)-1,7-DIAZASPIRO[4.4] NONANE AND NOVEL SALT FORMS OF THE RACEMATE AND ENANTIOMERS | TARGACEPT, INC. (US) | 2009-07-23 | — | — | WO | disclosed |