Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 4/20 | 0.43 |
| ▸ | HTR1A | P08908 | 3/20 | 0.43 |
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | HTR6 | P50406 | 3/20 | 0.43 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CASP1 | P29466 | 5/20 | 0.39 |
| ▸ | CASP7 | P55210 | 5/20 | 0.39 |
| ▸ | USP2 | O75604 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17057927 | 0.82 | HTR6 (0.41) | HTR7HTR1AHTR2BHTR6ALDH1A1 | |
| SCHEMBL11943913 | 0.79 | MAPT (0.48) | ALDH1A1NPSR1HSD17B10LMNASMN1; SMN2 | |
| SCHEMBL14282366 | 0.78 | NPBWR1 (0.51) | HTR1ANPBWR1MCHR1ALDH1A1NPSR1 | |
| SCHEMBL4649285 | 0.78 | NPBWR1 (0.53) | HTR7HTR1AHTR2BHTR6NPBWR1 | |
| SCHEMBL17058573 | 0.77 | GAA (0.48) | NPBWR1MCHR1ALDH1A1NPSR1HSD17B10 | |
| SCHEMBL4673910 | 0.77 | NPBWR1 (0.52) | HTR7HTR1AHTR2BHTR6NPBWR1 | |
| SCHEMBL17058306 | 0.76 | TP53 (0.44) | HTR7HTR1AHTR2BHTR6NPBWR1 | |
| SCHEMBL11943546 | 0.76 | MAPT (0.45) | NPBWR1ALDH1A1NPSR1LMNASMN1; SMN2 | |
| SCHEMBL17058140 | 0.75 | USP2 (0.35) | HTR7HTR1AHTR2BHTR6MCHR1 | |
| SCHEMBL17058324 | 0.75 | HTR1A (0.38) | HTR7HTR1AHTR2BHTR6ALDH1A1 |
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-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |