Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA7 | P43166 | 1/20 | 0.50 |
| ▸ | CTSK | P43235 | 10/20 | 0.47 |
| ▸ | CTSS | P25774 | 6/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL14265317 | 0.85 | CA1 (0.53) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL23719231 | 0.83 | CA1 (0.53) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL969077 | 0.83 | CA1 (0.67) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL68450 | 0.83 | CA1 (0.67) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL68451 | 0.83 | CA1 (0.67) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL272148 | 0.81 | CA1 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL16970604 | 0.81 | CA1 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL10966087 | 0.81 | CA1 (0.51) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL8961360 | 0.81 | CA1 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL10657973 | 0.81 | CA1 (0.47) | CA1CA2CA7CTSKCTSS |
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-2004089362-A1 | 2-CYANOPYRROLES AND THEIR ANALOGUES AS DDP-IV INHIBITORS | NOVO NORDISK A/S (DK) | 2004-10-21 | — | — | WO | disclosed |