Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | FURIN | P09958 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.42 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.38 |
| ▸ | CHRNA10 | Q9GZZ6 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8547301 | 1.00 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL8547303 | 1.00 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL8547307 | 1.00 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL833489 | 0.92 | ALDH1A1 (0.58) | ALDH1A1KDM4ECYP2A6FAAHEPHX2 | |
| SCHEMBL1552647 | 0.88 | ALDH1A1 (0.51) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL15382502 | 0.86 | ALDH1A1 (0.53) | ALDH1A1KDM4ECYP2A6FAAHEPHX2 | |
| SCHEMBL3636729 | 0.86 | ALDH1A1 (0.56) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL510213 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL510687 | 0.82 | HPGD (0.56) | ALDH1A1KDM4ECYP2A6FURINFAAH | |
| SCHEMBL4058730 | 0.82 | HPGD (0.56) | ALDH1A1KDM4ECYP2A6FURINFAAH |
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-0696585-B1 | NOVEL BISOXADIAZOLIDINE DERIVATIVE | YAMANOUCHI PHARMA CO LTD (JP) | 1998-12-16 | — | — | EP | disclosed |
| US-5643931-A | ANTIDIABETIC AGENTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1997-07-01 | — | — | US | disclosed |
| EP-0696585-A1 | NOVEL BISOXADIAZOLIDINE DERIVATIVE | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-02-14 | — | — | EP | disclosed |