Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 7/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | PEPD | P12955 | 1/20 | 0.31 |
| ▸ | MPO | P05164 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11417635 | 0.76 | ESR1 (0.43) | ESR1ESR2CA2PEPDMPO | |
| SCHEMBL15519775 | 0.75 | NNMT (0.44) | — | |
| SCHEMBL5533968 | 0.71 | NPSR1 (0.45) | HCAR2CA2NPC1RAB9A | |
| SCHEMBL1013105 | 0.71 | TRPM8 (0.39) | HCAR2 | |
| SCHEMBL4561593 | 0.70 | HCAR2 (0.39) | HCAR2NPC1RAB9A | |
| SCHEMBL27584809 | 0.70 | HCAR2 (0.33) | HCAR2ESR1ESR2 | |
| SCHEMBL27296095 | 0.70 | NPSR1 (0.52) | ESR1ESR2CA2NPC1RAB9A | |
| SCHEMBL6037486 | 0.68 | ACHE (0.52) | ESR1ESR2CA2PEPDNPC1 | |
| SCHEMBL15542608 | 0.68 | HCAR2 (0.37) | HCAR2NPC1RAB9A | |
| SCHEMBL27537276 | 0.66 | HCAR2 (0.38) | HCAR2MPOCYP3A4NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2890693-A1 | PYRAZOLE DERIVATIVES AS P38 MAP INHIBITORS | Respivert Limited (GB) | 2015-07-08 | — | — | EP | claimed |
| WO-2014033448-A1 | PYRAZOLE DERIVATIVES AS P38 MAP INHIBITORS | RESPIVERT LIMTED (GB) | 2014-03-06 | — | — | WO | claimed |