Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.40 |
| ▸ | HRH1 | P35367 | 6/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.37 |
| ▸ | CES2 | O00748 | 1/20 | 0.37 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 2/20 | 0.33 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22042217 | 0.88 | HRH1 (0.44) | HTR2AHRH1SIGMAR1TRPA1CES2 | |
| SCHEMBL4450297 | 0.86 | HRH1 (0.41) | HTR2AHRH1SIGMAR1TRPA1CES2 | |
| SCHEMBL22042211 | 0.83 | HRH1 (0.46) | HTR2AHRH1TRPA1CES2CES1 | |
| SCHEMBL14307122 | 0.82 | HTR2A (0.40) | HTR2AHRH1SIGMAR1TRPA1CES2 | |
| SCHEMBL904449 | 0.81 | HRH1 (0.60) | HTR2AHRH1SIGMAR1TAAR1 | |
| SCHEMBL3841684 | 0.80 | HTR2A (0.36) | HTR2A | |
| SCHEMBL9789913 | 0.80 | HTR2A (0.65) | HTR2AHRH1TAAR1TSHR | |
| SCHEMBL4889343 | 0.80 | HTR2A (0.39) | HTR2AHRH1SIGMAR1TRPA1CES2 | |
| SCHEMBL1920593 | 0.80 | POLB (0.45) | HTR2AHRH1SIGMAR1ALDH1A1 | |
| SCHEMBL1308306 | 0.78 | TRPA1 (0.40) | HTR2AHRH1SIGMAR1TRPA1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012054510-A1 | OXADIAZOLE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF | COMENTIS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |
| US-3992251-A | Process of making wet strength paper containing mono primary polyamine and organic dihalide modified, epoxidized polyamide | DIAMOND SHAMROCK CORPORATION (US) | 1976-11-16 | — | — | US | disclosed |