Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 18/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | F10 | P00742 | 6/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 6/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 6/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 5/20 | 0.39 |
| ▸ | F7 | P08709 | 4/20 | 0.39 |
| ▸ | F12 | P00748 | 3/20 | 0.39 |
| ▸ | F9 | P00740 | 1/20 | 0.38 |
| ▸ | PLAT | P00750 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.38 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6915417 | 1.00 | F2 (0.49) | F2CYP3A4F10PRSS1PRSS3 | |
| SCHEMBL6919558 | 0.87 | F2 (0.41) | F2CYP3A4F10PRSS1PRSS3 | |
| SCHEMBL6077615 | 0.86 | F2 (0.60) | F2F10PRSS1PRSS3PRSS2 | |
| SCHEMBL6921206 | 0.83 | F2 (0.49) | F2CYP3A4F10PRSS1PRSS3 | |
| SCHEMBL6915425 | 0.80 | F2 (0.42) | F2 | |
| SCHEMBL6078258 | 0.78 | F2 (0.57) | F2F10PRSS1PRSS3PRSS2 | |
| SCHEMBL8136992 | 0.76 | CYP3A4 (0.54) | F2CYP3A4F10PRSS1PRSS3 | |
| SCHEMBL6078157 | 0.76 | F2 (0.47) | F2 | |
| SCHEMBL6078951 | 0.76 | F2 (0.49) | F2CYP3A4 | |
| SCHEMBL6921244 | 0.75 | F2 (0.47) | F2CYP3A4F10PRSS1PRSS3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004032834-A2 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2004-04-22 | — | — | WO | claimed |
| WO-2004032834-A2 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2004-04-22 | — | — | WO | disclosed |