Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3727154 | 0.90 | TRPA1 (0.56) | ALDH1A1LMNANPSR1TRPA1HDAC1 | |
| SCHEMBL893768 | 0.86 | TRPA1 (0.53) | ALDH1A1LMNANPSR1TRPA1JAK2 | |
| SCHEMBL894253 | 0.85 | ALDH1A1 (0.53) | ALDH1A1LMNANPSR1TRPA1SMN1; SMN2 | |
| SCHEMBL893264 | 0.85 | ALDH1A1 (0.54) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL894009 | 0.85 | TRPA1 (0.42) | TRPA1HDAC1KDM1ATACR1 | |
| SCHEMBL893706 | 0.83 | HDAC1 (0.42) | TRPA1HDAC1USP30KDM1ATACR1 | |
| SCHEMBL20811541 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL28449589 | 0.83 | ALDH1A1 (0.56) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL7314949 | 0.82 | ALDH1A1 (0.59) | ALDH1A1LMNANPSR1SMN1; SMN2NPC1 | |
| SCHEMBL30001961 | 0.81 | HDAC1 (0.53) | ALDH1A1HDAC1SMN1; SMN2NPC1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |
| WO-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |