Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | STAT3 | P40763 | 2/20 | 0.54 |
| ▸ | LSS | P48449 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | CHKA | P35790 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL7074772 | 0.90 | MGLL (0.66) | MGLLALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL7071609 | 0.89 | NPC1 (0.65) | MGLLALDH1A1MAPTKMT2ALMNA | |
| SCHEMBL7999939 | 0.85 | MGLL (0.52) | MGLLKMT2AS1PR4S1PR1S1PR5 | |
| SCHEMBL7071582 | 0.80 | LMNA (0.60) | MGLLALDH1A1KMT2ALMNAMEN1 | |
| SCHEMBL7069980 | 0.80 | TSHR (0.54) | ALDH1A1MAPTLMNATSHRLSS | |
| SCHEMBL5928243 | 0.79 | TSHR (0.49) | ALDH1A1MAPTKMT2AKDM4ELMNA | |
| SCHEMBL7073717 | 0.79 | TSHR (0.57) | MGLLALDH1A1KMT2ALMNARECQL | |
| SCHEMBL12541538 | 0.79 | LSS (0.77) | MGLLALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL5225958 | 0.79 | SMN1; SMN2 (0.59) | ALDH1A1MAPTKDM4ELMNATSHR | |
| SCHEMBL7076687 | 0.79 | TSHR (0.59) | MGLLALDH1A1MAPTKMT2ALMNA |
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 |