Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.41 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GALR3 | O60755 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6153724 | 0.90 | MAPT (0.45) | MAPTALDH1A1NPSR1L3MBTL1GAA | |
| SCHEMBL6154622 | 0.78 | SMN1; SMN2 (0.55) | MAPTALDH1A1NPSR1L3MBTL1GAA | |
| SCHEMBL9293034 | 0.71 | IDO1 (0.58) | ALDH1A1GAAKMT2AMEN1POLB | |
| Ammonia Solution, Strong SCHEMBL10334616 | 0.70 | IDO1 (0.57) | ALDH1A1GAAKMT2AMEN1POLB | |
| SCHEMBL6154319 | 0.70 | ROCK1 (0.45) | MAPTALDH1A1NPSR1L3MBTL1GAA | |
| SCHEMBL7516731 | 0.67 | MAPT (0.47) | MAPTALDH1A1GAAKMT2ANPC1 | |
| Propane SCHEMBL10335007 | 0.67 | IDO1 (0.52) | ALDH1A1L3MBTL1GAAKMT2AMEN1 | |
| SCHEMBL6153416 | 0.67 | KMT2A (0.52) | MAPTALDH1A1NPSR1GAAKMT2A | |
| SCHEMBL6153460 | 0.67 | RRM1 (0.56) | MAPTALDH1A1NPSR1GAAKMT2A | |
| Isopropylamine SCHEMBL10335006 | 0.66 | IDO1 (0.54) | ALDH1A1L3MBTL1GAAKMT2AMEN1 |
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-1446110-A2 | ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES | Structural Bioinformatics Inc. (US) | 2004-08-18 | — | — | EP | disclosed |
| WO-2003032916-A2 | ORGANOSULFUR INHIBITORS OF TYROSINE PHOSPHATASES | STRUCTURAL BIOINFORMATICS INC. (US) | 2003-04-24 | — | — | WO | disclosed |