Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 6/20 | 0.48 |
| ▸ | GPBAR1 | Q8TDU6 | 8/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | DDR1 | Q08345 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.34 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7372915 | 0.87 | F2 (0.56) | F2GPBAR1CNR2CNR1F10 | |
| SCHEMBL7374615 | 0.85 | F2 (0.62) | F2F10PRSS1PRSS2PRSS3 | |
| SCHEMBL7373230 | 0.83 | F2 (0.47) | F2GPBAR1TSHRMAPK1RECQL | |
| SCHEMBL7379417 | 0.82 | F2 (0.48) | F2GPBAR1TSHRMAPK1RECQL | |
| SCHEMBL7377205 | 0.81 | TSHR (0.44) | F2GPBAR1TSHRMAPK1RECQL | |
| SCHEMBL7380524 | 0.80 | F2 (0.53) | F2GPBAR1TSHRMAPK1RECQL | |
| SCHEMBL6927719 | 0.80 | F2 (0.75) | F2ALDH1A1F10PRSS1PRSS2 | |
| SCHEMBL7378295 | 0.77 | F2 (0.62) | F2GPBAR1F10PRSS1PRSS2 | |
| SCHEMBL7377464 | 0.74 | F2 (0.54) | F2GPBAR1F10PRSS1PRSS2 | |
| SCHEMBL7452387 | 0.74 | F2 (0.52) | F2GPBAR1ALDH1A1F10PRSS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002050056-A1 | BENZYLAMINE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2002-06-27 | — | — | WO | disclosed |