Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.30 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.30 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | F10 | P00742 | 1/20 | 0.30 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.30 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL499226 | 0.94 | SLC6A9 (0.34) | SLC6A9KIF11KCNH2 | |
| Trifluoroacetic Acid SCHEMBL499608 | 0.89 | PDK2 (0.37) | SLC6A9HTR2CKIF11KCNH2PDK2 | |
| SCHEMBL4789528 | 0.86 | SLC6A9 (0.30) | SLC6A9 | |
| SCHEMBL499353 | 0.85 | SLC6A9 (0.35) | SLC6A9KCNH2PDK2 | |
| SCHEMBL10253752 | 0.83 | PDK2 (0.36) | SLC6A9HTR2CPDK2 | |
| SCHEMBL499980 | 0.78 | HPGD (0.34) | SLC6A9 | |
| SCHEMBL499028 | 0.74 | PDK2 (0.36) | SLC6A9HTR2CPDK2 | |
| SCHEMBL499029 | 0.74 | PDK2 (0.36) | SLC6A9HTR2CPDK2 | |
| Trifluoroacetic Acid SCHEMBL499182 | 0.69 | IDO1 (0.33) | PDK2 | |
| SCHEMBL8084228 | 0.68 | PDK2 (0.36) | SLC6A9HTR2CPDK2 |
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-2008156816-A2 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2008-12-24 | — | — | WO | disclosed |