Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3229698 | 0.79 | NR4A1 (0.41) | KDM4EPOLBNR4A1TDP1KMT2A | |
| SCHEMBL242273 | 0.73 | ALDH1A1 (0.70) | ALDH1A1HPGDKDM4ENR4A1RECQL | |
| SCHEMBL22823036 | 0.70 | TDP1 (0.45) | ALDH1A1HPGDKDM4EPOLBTDP1 | |
| SCHEMBL27667893 | 0.70 | CA12 (0.55) | KMT2ACA12CA1CA2CA9 | |
| SCHEMBL3863823 | 0.70 | CA12 (0.55) | KMT2ACA12CA1CA2CA9 | |
| SCHEMBL19873092 | 0.69 | TDP1 (0.48) | ALDH1A1HPGDKDM4EPOLBNR4A1 | |
| SCHEMBL11835765 | 0.69 | LMNA (0.56) | ALDH1A1POLBFFAR1MCL1AKR1C2 | |
| SCHEMBL10984187 | 0.68 | TDP1 (0.47) | ALDH1A1HPGDKDM4EPOLBTDP1 | |
| SCHEMBL5520513 | 0.68 | TDP1 (0.47) | ALDH1A1HPGDKDM4EPOLBTDP1 | |
| Isopropyl Alcohol SCHEMBL28733543 | 0.67 | TDP1 (0.50) | ALDH1A1HPGDKDM4EPOLBTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1663936-A1 | BIARYLOXYMETHYLARENE-CARBOXYLIC ACIDS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-06-07 | — | — | EP | disclosed |
| WO-2005000781-A1 | BIARYLOXYMETHYLARENE-CARBOXYLIC ACIDS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-01-06 | — | — | WO | disclosed |