Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 4/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7065619 | 1.00 | NCEH1 (0.40) | NCEH1SIGMAR1ALDH1A1KDM4ETDP1 | |
| SCHEMBL8803002 | 0.78 | SIGMAR1 (0.49) | NCEH1SIGMAR1KDM4EGAAALOX5 | |
| SCHEMBL7138305 | 0.77 | CASP1 (0.41) | SIGMAR1ALDH1A1KDM4ETDP1L3MBTL1 | |
| SCHEMBL27532540 | 0.77 | GAA (0.44) | NCEH1SIGMAR1ALDH1A1KDM4EGAA | |
| SCHEMBL27597531 | 0.76 | MEN1 (0.40) | NCEH1SIGMAR1ALDH1A1KDM4ETDP1 | |
| SCHEMBL6139113 | 0.76 | MEN1 (0.40) | NCEH1SIGMAR1ALDH1A1KDM4ETDP1 | |
| SCHEMBL6138885 | 0.76 | NPSR1 (0.44) | NCEH1SIGMAR1ALDH1A1KDM4ETDP1 | |
| SCHEMBL7065623 | 0.75 | NCEH1 (0.40) | NCEH1SIGMAR1ALDH1A1KDM4ETDP1 | |
| SCHEMBL2090835 | 0.74 | SIGMAR1 (0.61) | NCEH1SIGMAR1ALDH1A1GAAPGR | |
| SCHEMBL7142898 | 0.74 | SMPD2 (0.43) | ALDH1A1KDM4ETDP1L3MBTL1KMT2A |
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-1313696-A2 | AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS | ABBOTT LABORATORIES (US) | 2003-05-28 | — | — | EP | disclosed |
| WO-2002018323-A2 | AMINO(OXO)ACETIC ACID PROTEIN TYROSINE PHOSPHATASE INHIBITORS | ABBOTT LABORATORIES (US) | 2002-03-07 | — | — | WO | disclosed |