Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | F10 | P00742 | 1/20 | 0.56 |
| ▸ | SETD7 | Q8WTS6 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | F11 | P03951 | 1/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27568113 | 0.96 | GAA (0.56) | GAAF10SETD7MAPK1ALDH1A1 | |
| SCHEMBL4003521 | 0.84 | CA12 (0.65) | GAASETD7MAPK1ALDH1A1HTT | |
| SCHEMBL7069792 | 0.84 | F10 (0.53) | GAAF10ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL12302056 | 0.83 | MEN1 (0.70) | GAASETD7MAPK1ALDH1A1HTT | |
| SCHEMBL24064947 | 0.82 | F11 (0.55) | ALDH1A1MEN1KMT2AF11 | |
| SCHEMBL7074218 | 0.82 | ALDH1A1 (0.67) | GAAMAPK1ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL7074838 | 0.82 | F10 (0.54) | GAAF10ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL13268583 | 0.81 | CA12 (0.63) | GAASETD7MAPK1ALDH1A1HTT | |
| SCHEMBL2474167 | 0.81 | GAA (0.59) | GAASETD7MAPK1ALDH1A1HTT | |
| SCHEMBL7076666 | 0.81 | LMNA (0.72) | GAAF10MAPK1ALDH1A1MEN1 |
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-1025086-B1 | BENZAMIDINE DERIVATIVES AS FACTOR XA INHIBITORS | MERCK PATENT GMBH (DE) | 2003-06-25 | — | — | EP | disclosed |
| US-6492368-B1 | Benzamidine derivatives as factor XA inhibitors | MERCK PATENT GMBH (DE) | 2002-12-10 | — | — | US | disclosed |