Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 5/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.38 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.38 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAP2K4 | P45985 | 1/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.38 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.38 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.38 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.38 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 2/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.37 |
| ▸ | BCR | P11274 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL102139 | 0.85 | TDP1 (0.36) | ACHEMAPK1NPC1RAB9AMEN1 | |
| SCHEMBL6860834 | 0.83 | ACHE (0.46) | ACHEESR1ESR2CSNK2A2CSNK2B | |
| SCHEMBL3125580 | 0.81 | ESR1 (0.44) | ESR1ESR2HSD17B1HSD17B2ABL1 | |
| SCHEMBL11512588 | 0.80 | ACHE (0.41) | ACHENPC1RAB9AMEN1KMT2A | |
| SCHEMBL1491043 | 0.80 | ACHE (0.41) | ACHENPC1RAB9AMEN1KMT2A | |
| SCHEMBL4125762 | 0.80 | MAOB (0.37) | NPC1RAB9AMEN1KMT2AMAOB | |
| SCHEMBL2154312 | 0.80 | AHR (0.34) | CSNK2A2CSNK2BCSNK2A1NPC1RAB9A | |
| SCHEMBL9372374 | 0.80 | ACHE (0.41) | ACHEESR1ESR2CSNK2A2CSNK2B | |
| SCHEMBL4279134 | 0.79 | ACHE (0.50) | ACHEESR1ESR2CSNK2A2CSNK2B | |
| SCHEMBL193137 | 0.79 | MAOB (0.39) | ACHENPC1RAB9AMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7662842-B2 | Thiazolidinone amides, thiazolidine carboxylic acid amides, and serine amides, including polyamine conjugates thereof, as selective anti-cancer agents | Ohio State Univesity Research Foundation (US) | 2010-02-16 | — | — | US | claimed |
| EP-0144594-A1 | Derivatives of 5H-[1]benzopyrano-[2,3-d]-pyrimidines, process for their preparation and medicines containing them, useful against gastral and duodenal lesions of the mucosa | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1985-06-19 | — | — | EP | disclosed |