Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.52 |
| ▸ | HPGD | P15428 | 7/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | GRM6 | O15303 | 3/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7175525 | 0.89 | ALDH1A1 (0.52) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL7510244 | 0.89 | ALDH1A1 (0.47) | ALDH1A1HPGDNPC1POLBMAPT | |
| SCHEMBL5815696 | 0.85 | CDC7 (0.43) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL7013488 | 0.83 | ALDH1A1 (0.55) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL5124093 | 0.81 | ALDH1A1 (0.75) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL7172235 | 0.80 | KDM4E (0.56) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL7515109 | 0.78 | ALDH1A1 (0.47) | ALDH1A1HPGDSMN1; SMN2MAPTKDM4E | |
| SCHEMBL7016074 | 0.73 | MEN1 (0.47) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL5129672 | 0.72 | ALDH1A1 (0.75) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 | |
| SCHEMBL12599782 | 0.71 | MAPT (0.53) | ALDH1A1HPGDNPC1POLBSMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0920431-B1 | THIENOPYRIMIDINES | MERCK PATENT GMBH (DE) | 2003-02-26 | — | — | EP | disclosed |