Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL12164545 | 0.81 | CYP1A2 (0.43) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25918428 | 0.77 | NPC1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29352597 | 0.74 | CA12 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL83318 | 0.74 | CA12 (0.53) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29555340 | 0.73 | RAB9A (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL168299 | 0.73 | RAB9A (0.46) | CA12CA1CA2CA7CA9 | |
| SCHEMBL12809824 | 0.72 | ERN1 (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL29096230 | 0.72 | CA12 (0.54) | CA12CA1CA2CA7CA9 | |
| SCHEMBL12326180 | 0.72 | CA1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL24456046 | 0.70 | HTT (0.34) | CA12CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2422790-A1 | Paramyxovirus family inhibitors and methods of use thereof | Emory University (US) | 2012-02-29 | — | — | EP | disclosed |