Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 3/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5226619 | 0.89 | NPBWR1 (0.47) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5228410 | 0.85 | PTGS1 (0.49) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5229004 | 0.84 | NPBWR1 (0.40) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5228824 | 0.83 | ICMT (0.40) | PTGS1TP53KDM4EALDH1A1HPGD | |
| SCHEMBL5224302 | 0.83 | SMO (0.49) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5224853 | 0.82 | HSD17B10 (0.43) | TP53KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5224947 | 0.81 | ALDH1A1 (0.38) | TP53KDM4EMAPTALDH1A1HPGD | |
| SCHEMBL5225666 | 0.80 | NPBWR1 (0.43) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5232263 | 0.79 | SMO (0.49) | NPBWR1MCHR1PTGS1PTGS2TP53 | |
| SCHEMBL5230456 | 0.78 | SMO (0.46) | NPBWR1MCHR1PTGS1PTGS2TP53 |
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 |