Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.32 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8328279 | 0.86 | DNM1 (0.39) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8322051 | 0.83 | ALDH1A1 (0.42) | ALDH1A1KDM4EPOLBGAAL3MBTL1 | |
| SCHEMBL8324185 | 0.81 | CHRM2 (0.39) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8328869 | 0.81 | CHRM2 (0.44) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8329010 | 0.81 | CHRM2 (0.41) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8330575 | 0.80 | MEN1 (0.35) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8325662 | 0.80 | CHRM2 (0.46) | ALDH1A1KDM4EPOLBGAALMNA | |
| SCHEMBL8328033 | 0.77 | CTSS (0.32) | — | |
| SCHEMBL8329466 | 0.73 | NRP1 (0.33) | ALDH1A1KDM4EGAAL3MBTL1MAPK1 | |
| SCHEMBL8324755 | 0.71 | SIGMAR1 (0.37) | ALDH1A1GAAMITFMAPK1HTT |
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-0760368-B1 | PYRIMIDINE DERIVATIVES | NISSHIN FLOUR MILLING CO (JP) | 1999-07-28 | — | — | EP | disclosed |
| US-5736550-A | TREATMENT OF GASTROINTESTINAL TRACT DISORDERS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-04-07 | — | — | US | disclosed |
| EP-0760368-A1 | NOVEL PYRIMIDINE DERIVATIVE | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1997-03-05 | — | — | EP | disclosed |