Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 17/20 | 0.54 |
| ▸ | CA2 | P00918 | 17/20 | 0.54 |
| ▸ | CA9 | Q16790 | 16/20 | 0.54 |
| ▸ | CA12 | O43570 | 4/20 | 0.53 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA3 | P07451 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA7 | P43166 | 1/20 | 0.53 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3717794 | 0.87 | PTGS1 (0.54) | CA1CA2CA9CA12CA14 | |
| SCHEMBL3718666 | 0.83 | KDM4E (0.55) | CA1CA2CA9CA12CA14 | |
| SCHEMBL3722029 | 0.77 | L3MBTL1 (0.44) | KDM4E | |
| SCHEMBL3720119 | 0.75 | ACP1 (0.44) | KDM4E | |
| SCHEMBL3723261 | 0.75 | PTGS1 (0.48) | CA1CA2CA9KDM4EPTGS1 | |
| SCHEMBL3720305 | 0.74 | PIK3CA (0.43) | — | |
| SCHEMBL3727322 | 0.71 | AGTR1 (0.43) | KDM4E | |
| SCHEMBL3717789 | 0.71 | SCN9A (0.53) | CA1CA2CA9CA12CA14 | |
| SCHEMBL3723029 | 0.69 | KDM4E (0.53) | KDM4E | |
| SCHEMBL3717784 | 0.69 | ACP1 (0.47) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8614201-B2 | Heterocyclic amides as modulators of TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2013-12-24 | — | — | US | disclosed |
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |