Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMO | O15229 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL10068936 | 0.85 | HSD17B10 (0.51) | ALDH1A1KDM4EHSD17B10SMN1; SMN2ATM | |
| SCHEMBL8619431 | 0.83 | HSD17B10 (0.50) | ALDH1A1KMT2AKDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL4389273 | 0.79 | CA12 (0.52) | ALDH1A1KDM4EHSD17B10SMN1; SMN2ATM | |
| SCHEMBL3343549 | 0.79 | CA12 (0.52) | ALDH1A1KDM4EHSD17B10SMN1; SMN2PTGS2 | |
| SCHEMBL10068933 | 0.79 | KMO (0.51) | ALDH1A1KMT2AKDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL184149 | 0.78 | HSD17B10 (0.54) | ALDH1A1KDM4EHSD17B10CA12CA1 | |
| SCHEMBL15054040 | 0.78 | ATAD2 (0.44) | ALDH1A1KDM4EHSD17B10SMN1; SMN2ATM | |
| SCHEMBL10068703 | 0.78 | KMO (0.54) | ALDH1A1KMT2AKDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL29639680 | 0.77 | LCK (0.43) | GPBAR1ALDH1A1KMT2APTGS2KMO | |
| SCHEMBL12097672 | 0.77 | LCK (0.43) | GPBAR1ALDH1A1KMT2APTGS2KMO |
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 |
|---|---|---|---|---|---|---|---|
| US-5693672-A | 3,4,5-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic and medicament containing them | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-12-02 | — | — | US | disclosed |