Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | P4HB | P07237 | 2/20 | 0.39 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 4/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1741664 | 0.84 | TRPV4 (0.45) | TRPV4KIF11P4HBMRGPRX4HDAC1 | |
| SCHEMBL22193269 | 0.81 | TRPV4 (0.53) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL22596657 | 0.80 | TRPV4 (0.46) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL24146520 | 0.78 | RXRA (0.50) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL1037550 | 0.78 | TRPV4 (0.49) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL10298852 | 0.78 | TRPV4 (0.49) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL2263818 | 0.78 | TRPV4 (0.49) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL7569957 | 0.77 | TRPV4 (0.58) | TRPV4KIF11P4HBMRGPRX4AR | |
| SCHEMBL21807243 | 0.76 | IDO1 (0.54) | KIF11HDAC1HDAC6 | |
| SCHEMBL6193600 | 0.76 | DAO (0.47) | RXRARXRBRXRG |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2390252-A1 | New pyrazole derivatives | Almirall, S.A. (ES) | 2011-11-30 | — | — | EP | disclosed |
| EP-2390252-A1 | New pyrazole derivatives | Almirall, S.A. (ES) | 2011-11-30 | — | — | EP | disclosed |
| WO-2011144338-A1 | PYRAZOLE DERIVATIVES AS S1P1 AGONISTS | ALMIRALL, S.A. (ES) | 2011-11-24 | — | — | WO | disclosed |