Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 4/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL15145693 | 1.00 | HTR5A (0.39) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL29155359 | 0.78 | HTR5A (0.40) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23016970 | 0.77 | PNMT (0.37) | ADRA2AADRA2BADRA2CLMNAGAA | |
| SCHEMBL29529402 | 0.77 | LMNA (0.46) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23788032 | 0.77 | HTR5A (0.38) | HTR5APDE3AACHELMNAGAA | |
| SCHEMBL8937088 | 0.77 | LMNA (0.46) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL30681298 | 0.77 | LMNA (0.46) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL27461755 | 0.75 | GAA (0.60) | HTR5AGAAMAPT | |
| SCHEMBL27303285 | 0.75 | GAA (0.60) | HTR5AGAAMAPT | |
| SCHEMBL31083392 | 0.74 | CHRNB2 (0.41) | HTR5ACHRNB2CHRNB4CHRNA3CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007087419-A2 | SUBSTITUTED 3-(5-MEMBERED UNSATURATED HETEROCYCLYL) -1, 3-DIHYDRO-INDOL-2-ONE DERIVATIVES AS TYROSINE KINASE INHIBITORS FOR THE TREATMENT OF CANCER | ALLERGAN, INC. (US) | 2007-08-02 | — | — | WO | disclosed |