Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL132252 | 0.81 | GABRA1 (0.46) | TSHRSMN1; SMN2NPSR1KDM4EIDO1 | |
| SCHEMBL17664492 | 0.77 | FEN1 (0.46) | KDRMAPK14TNNI3KIDO1 | |
| SCHEMBL18224103 | 0.76 | NPSR1 (0.40) | NPSR1KDM4E | |
| SCHEMBL811160 | 0.76 | NPSR1 (0.53) | TSHRSMN1; SMN2NPSR1KDM4E | |
| SCHEMBL29595709 | 0.76 | NPSR1 (0.53) | TSHRSMN1; SMN2NPSR1KDM4E | |
| SCHEMBL22256396 | 0.75 | KDM4E (0.50) | TSHRSMN1; SMN2KDM4EMAPK1TRPV1 | |
| SCHEMBL706407 | 0.75 | TSHR (0.63) | TSHRSMN1; SMN2NPSR1KDM4EMAPK1 | |
| SCHEMBL30980818 | 0.75 | TSHR (0.63) | TSHRSMN1; SMN2NPSR1KDM4EMAPK1 | |
| SCHEMBL16647601 | 0.74 | TRPA1 (0.40) | NPSR1KDM4EMAPK1 | |
| SCHEMBL16635112 | 0.74 | TRPA1 (0.42) | NPSR1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-105612153-A | Substituted sulfonamide compounds as TRPA1 conditioner | HOFFMANN LA ROCHE | 2016-05-25 | — | — | CN | disclosed |