Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 13/20 | 0.51 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5178074 | 0.89 | KLKB1 (0.52) | KLKB1EPHX2CA2NR1H4ROCK2 | |
| SCHEMBL5178321 | 0.82 | KLKB1 (0.47) | KLKB1EPHX2CA2NR1H4ROCK2 | |
| SCHEMBL8266479 | 0.82 | F10 (0.48) | KLKB1EPHX2ROCK2ROCK1PLAU | |
| SCHEMBL5094014 | 0.82 | CA1 (0.49) | KLKB1CA2 | |
| Acetic Acid SCHEMBL5178953 | 0.80 | F10 (0.48) | KLKB1EPHX2NR1H4PLAU | |
| Hydrochloric Acid SCHEMBL5178223 | 0.79 | F10 (0.53) | KLKB1EPHX2ROCK2ROCK1PLAU | |
| SCHEMBL5177725 | 0.79 | KLKB1 (0.44) | KLKB1ROCK2ROCK1 | |
| SCHEMBL8266177 | 0.79 | F10 (0.52) | KLKB1 | |
| Hydrochloric Acid SCHEMBL5138361 | 0.78 | F10 (0.52) | KLKB1 | |
| Hydrochloric Acid SCHEMBL5177719 | 0.78 | KLKB1 (0.44) | KLKB1ROCK2ROCK1 |
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-1791810-A1 | 4-AMINOMETHYL BENZAMIDINE DERIVATIVES AND THEIR USE AS FACTOR VIIA INHIBITORS | F. Hoffmann-Roche AG (CH) | 2007-06-06 | — | — | EP | disclosed |
| WO-2006027135-A1 | 4-AMINOMETHYL BENZAMIDINE DERIVATIVES AND THEIR USE AS FACTOR VIIIA INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-03-16 | — | — | WO | disclosed |