Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | F2 | P00734 | 4/20 | 0.45 |
| ▸ | F10 | P00742 | 4/20 | 0.45 |
| ▸ | PLG | P00747 | 1/20 | 0.45 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.45 |
| ▸ | PROC | P04070 | 1/20 | 0.45 |
| ▸ | TLR2 | O60603 | 1/20 | 0.43 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.43 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.43 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.43 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.43 |
| ▸ | PSMB10 | P40306 | 1/20 | 0.43 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.43 |
| ▸ | NPY1R | P25929 | 7/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15308907 | 0.87 | F2 (0.51) | F2F10PLGKLKB1PROC | |
| SCHEMBL321996 | 0.86 | CTSB (0.46) | ITGB3ITGA2BF2F10PLG | |
| SCHEMBL10056582 | 0.84 | KLKB1 (0.55) | KLKB1 | |
| SCHEMBL8347771 | 0.82 | TMPRSS11D (0.58) | CA1CA2F2F10PLG | |
| SCHEMBL15308902 | 0.79 | F2 (0.49) | F2F10PLGKLKB1PROC | |
| SCHEMBL16821242 | 0.77 | ITGB3 (0.56) | CA1CA2ITGB3ITGA2BF2 | |
| SCHEMBL16288707 | 0.76 | TLR2 (0.58) | CA1CA2TLR2NPY1RNPY5R | |
| SCHEMBL30309011 | 0.76 | ITGB3 (0.65) | CA1CA2ITGB3ITGA2BTLR2 | |
| SCHEMBL8289977 | 0.75 | F2 (0.61) | F2F10PLGKLKB1PROC | |
| SCHEMBL5969435 | 0.74 | ANPEP (0.46) | CA1TMPRSS11D |
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-2012004678-A2 | SERINE PROTEASE INHIBITORS | THE MEDICINES COMPANY (LEIPZIG) GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |