Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 6/20 | 0.52 |
| ▸ | GABRB2 | P47870 | 6/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 6/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARD | Q03181 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL525549 | 0.87 | SLC6A4 (0.59) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL725835 | 0.86 | SLC6A2 (0.60) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| SCHEMBL14125144 | 0.77 | GABRA1 (0.81) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| SCHEMBL9404982 | 0.76 | ALDH1A1 (0.58) | GABRA1GABRB2ALOX5ALDH1A1PPARG | |
| SCHEMBL525899 | 0.76 | SLC6A4 (0.52) | GABRA1GABRB2MEN1KMT2ACYP3A4 | |
| SCHEMBL525534 | 0.76 | GABRA1 (0.54) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL530274 | 0.75 | GABRA1 (0.53) | GABRA1GABRB2ALOX5CNR2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL726060 | 0.75 | SLC6A4 (0.51) | GABRA1GABRB2MEN1KMT2ACYP3A4 | |
| SCHEMBL526216 | 0.75 | SLC6A4 (0.48) | ALDH1A1MEN1KMT2ACYP3A4HTT | |
| SCHEMBL9772801 | 0.74 | SLC6A2 (0.68) | MEN1KMT2ACYP3A4LMNASLC6A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2423181-A1 | Multitarget substituted biphenyl diol derivatives | PROUS INSTITUTE FOR BIOMEDICAL RESEARCH S.A. (ES) | 2012-02-29 | — | — | EP | disclosed |
| EP-2423181-A1 | Multitarget substituted biphenyl diol derivatives | PROUS INSTITUTE FOR BIOMEDICAL RESEARCH S.A. (ES) | 2012-02-29 | — | — | EP | disclosed |
| WO-2012013691-A1 | MULTITARGET SUBSTITUTED BIPHENYL DIOL DERIVATIVES | PROUS INSTITUTE FOR BIOMEDICAL RESEARCH, S.A. (ES) | 2012-02-02 | — | — | WO | disclosed |
| WO-2012013691-A1 | MULTITARGET SUBSTITUTED BIPHENYL DIOL DERIVATIVES | PROUS INSTITUTE FOR BIOMEDICAL RESEARCH, S.A. (ES) | 2012-02-02 | — | — | WO | disclosed |