Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.40 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | XIAP | P98170 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL27532540 | 0.82 | GAA (0.44) | NCEH1ALDH1A1KDM4ESIGMAR1MEN1 | |
| SCHEMBL2090835 | 0.77 | SIGMAR1 (0.61) | NCEH1ALDH1A1SIGMAR1GAAPGR | |
| SCHEMBL7065619 | 0.75 | NCEH1 (0.40) | NCEH1ALDH1A1KDM4ETDP1SIGMAR1 | |
| SCHEMBL7065626 | 0.75 | NCEH1 (0.40) | NCEH1ALDH1A1KDM4ETDP1SIGMAR1 | |
| SCHEMBL4847152 | 0.73 | SMPD2 (0.44) | SIGMAR1ALOX5 | |
| SCHEMBL9540683 | 0.73 | NCEH1 (0.39) | NCEH1ALDH1A1KDM4ESIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL7437007 | 0.72 | SMPD2 (0.43) | SIGMAR1CARM1PRMT6ALOX5 | |
| SCHEMBL5558314 | 0.70 | SIGMAR1 (0.38) | ALDH1A1KDM4ESIGMAR1GAAALOX5 | |
| SCHEMBL6685262 | 0.70 | SIGMAR1 (0.48) | ALDH1A1KDM4ESIGMAR1GAAALOX5 | |
| SCHEMBL11024265 | 0.70 | GAA (0.77) | ALDH1A1KDM4ETDP1SIGMAR1GAA |
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 |