Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 12/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6838954 | 0.86 | F10 (0.37) | GHSRPYGL | |
| SCHEMBL6832689 | 0.85 | CTSK (0.38) | GHSRPYGL | |
| SCHEMBL6829592 | 0.85 | NPC1 (0.48) | — | |
| SCHEMBL6833075 | 0.82 | F10 (0.32) | GHSRPYGL | |
| SCHEMBL6833095 | 0.81 | PYGL (0.42) | GHSRPYGL | |
| SCHEMBL5258079 | 0.81 | PLA2G7 (0.35) | CYP2C9NAMPTMMP2MMP13PLA2G7 | |
| SCHEMBL6839074 | 0.81 | GHSR (0.41) | GHSRPYGL | |
| SCHEMBL5258087 | 0.81 | PLA2G7 (0.35) | CYP2C9NAMPTMMP2MMP13PLA2G7 | |
| SCHEMBL7070887 | 0.80 | PYGL (0.42) | GHSRPYGL | |
| SCHEMBL14565630 | 0.78 | MMP2 (0.38) | CYP2C9NAMPTMMP2MMP13PLA2G7 |
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 |
|---|---|---|---|---|---|---|---|
| US-6747053-B2 | Heteroaryl nitriles | ROCHE PALO ALTO LLC | 2004-06-08 | — | — | US | disclosed |