Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 8/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL15740437 | 0.95 | MAPK1 (0.38) | MAPK1NPSR1MCHR1TMEM97CXCR3 | |
| SCHEMBL15740426 | 0.88 | HRH3 (0.42) | MAPK1NPSR1MCHR1TMEM97SERPINE1 | |
| SCHEMBL15740442 | 0.88 | MAPK1 (0.39) | MAPK1NPSR1MCHR1TMEM97HTR2C | |
| SCHEMBL15740454 | 0.88 | TMEM97 (0.37) | MAPK1NPSR1TMEM97SERPINE1ROCK2 | |
| SCHEMBL15740432 | 0.85 | MAPK1 (0.36) | MAPK1NPSR1TMEM97SERPINE1ROCK2 | |
| SCHEMBL15740430 | 0.85 | MAPK1 (0.37) | MAPK1NPSR1TMEM97SERPINE1CES2 | |
| SCHEMBL15740364 | 0.84 | SIRT6 (0.41) | MAPK1NPSR1TMEM97SERPINE1CES2 | |
| SCHEMBL15707912 | 0.84 | MCHR1 (0.42) | MAPK1NPSR1MCHR1TMEM97CXCR3 | |
| SCHEMBL15727599 | 0.84 | MCHR1 (0.42) | MAPK1NPSR1MCHR1TMEM97CXCR3 | |
| SCHEMBL15740443 | 0.83 | TMEM97 (0.37) | MAPK1NPSR1TMEM97CHRM1 |
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-2922845-A2 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | Merial, Inc. (US) | 2015-09-30 | — | — | EP | disclosed |
| WO-2014081697-A2 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | MERIAL LIMITED (US) | 2014-05-30 | — | — | WO | disclosed |