Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 4/20 | 0.46 |
| ▸ | HRH1 | P35367 | 4/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 3/20 | 0.39 |
| ▸ | PLG | P00747 | 3/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10305165 | 0.84 | HRH2 (0.51) | HRH2HRH1FPR2HPGD | |
| SCHEMBL13374258 | 0.78 | NAAA (0.43) | HRH2HRH1NAAACHRM1HDAC3 | |
| SCHEMBL4214360 | 0.77 | FPR2 (0.52) | CHRM1FPR2MMP1MMP3ALDH1A1 | |
| SCHEMBL4205338 | 0.77 | FPR2 (0.52) | CHRM1FPR2MMP1MMP3ALDH1A1 | |
| SCHEMBL5552607 | 0.77 | FPR2 (0.52) | CHRM1FPR2MMP1MMP3ALDH1A1 | |
| Hydrochloric Acid SCHEMBL4208689 | 0.77 | NAAA (0.42) | HRH2HRH1NAAACHRM1HDAC3 | |
| SCHEMBL10305153 | 0.77 | NAAA (0.45) | HRH2HRH1NAAACHRM1HDAC3 | |
| SCHEMBL10305190 | 0.77 | NAAA (0.45) | HRH2HRH1NAAACHRM1HDAC3 | |
| SCHEMBL13375723 | 0.76 | CHRM1 (0.44) | CHRM1FPR2HPGDMMP1MMP3 | |
| SCHEMBL10305175 | 0.76 | CHRM1 (0.44) | CHRM1FPR2HPGDMMP1MMP3 |
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-2474534-A1 | 3-Aryl-3-hydroxy-2-amino-propionic acid amides, 3-heteroaryl-3-hydroxy-2-amino-propionic acid amides and related compounds having analgesic and/or immunostimulant activity | Allergan, Inc. (US) | 2012-07-11 | — | — | EP | disclosed |