Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MMP1 | P03956 | 3/20 | 0.33 |
| ▸ | MMP3 | P08254 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9709386 | 0.77 | TRPA1 (0.39) | ALDH1A1TRPA1KMT2AMMP1MMP3 | |
| SCHEMBL8378633 | 0.77 | TSHR (0.40) | ALDH1A1TRPA1KMT2AMMP1MMP3 | |
| SCHEMBL8378631 | 0.77 | TSHR (0.40) | ALDH1A1TRPA1KMT2AMMP1MMP3 | |
| SCHEMBL2305600 | 0.75 | MMP1 (0.40) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5021050 | 0.75 | MMP1 (0.40) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL5021055 | 0.75 | MMP1 (0.40) | ALDH1A1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL7456355 | 0.74 | SIGMAR1 (0.40) | ALDH1A1KMT2AMMP1MMP3TSHR | |
| SCHEMBL9328418 | 0.73 | ALDH1A1 (0.45) | ALDH1A1KMT2ATSHRMEN1LMNA | |
| SCHEMBL9841017 | 0.70 | KMT2A (0.40) | ALDH1A1KMT2AMMP1MMP3TSHR | |
| SCHEMBL2305614 | 0.70 | HSD17B10 (0.39) | ALDH1A1KMT2AMMP1MMP3MEN1 |
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-2348865-B1 | BETA-HYDROXY-GAMMA-AMINOPHOSPHONATES AND METHODS FOR THE PREPARATION AND USE THEREOF | NUCITEC SA DE CV (MX) | 2015-07-15 | — | — | EP | disclosed |