Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 7/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | SMO | Q99835 | 2/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5224916 | 0.82 | SMO (0.44) | LMNAALDH1A1SMONPSR1KCNH2 | |
| SCHEMBL5227096 | 0.80 | SMO (0.44) | LMNAALDH1A1SMONPSR1 | |
| SCHEMBL5222796 | 0.80 | NR3C1 (0.35) | NR3C1PGRPTGS2LMNANPC1 | |
| SCHEMBL5225124 | 0.77 | PIK3CD (0.42) | NR3C1PTGS2LMNANPC1ALDH1A1 | |
| SCHEMBL5228292 | 0.76 | SMO (0.37) | SMO | |
| SCHEMBL5227271 | 0.72 | DHODH (0.39) | NR3C1PGRLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL5227418 | 0.72 | PTGS1 (0.38) | NR3C1LMNANPC1ALDH1A1RAB9A | |
| SCHEMBL5229176 | 0.71 | SMO (0.39) | LMNAALDH1A1SMONPSR1 | |
| SCHEMBL5226500 | 0.71 | PTGS1 (0.36) | NR3C1PGRLMNANPC1ALDH1A1 | |
| SCHEMBL5228311 | 0.69 | NR3C1 (0.34) | NR3C1PGRLMNANPC1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |