Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 2/20 | 0.31 |
| ▸ | TRPV4 | Q9HBA0 | 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 | |
|---|---|---|---|---|
| SCHEMBL9330894 | 0.97 | ALDH1A1 (0.32) | ALDH1A1HPGDTP53KDM4EGLA | |
| SCHEMBL25778068 | 0.81 | HTT (0.35) | ALDH1A1HPGDKDM4EMAPTSMN1; SMN2 | |
| SCHEMBL25613942 | 0.81 | AR (0.42) | ALDH1A1HPGDTP53KDM4EGLA | |
| SCHEMBL25778072 | 0.81 | HTT (0.33) | MAPTMAPK1SMN1; SMN2AR | |
| SCHEMBL25613932 | 0.81 | AR (0.42) | ALDH1A1HPGDTP53KDM4EGLA | |
| SCHEMBL27355186 | 0.81 | NOTUM (0.31) | AR | |
| SCHEMBL25983363 | 0.79 | KDM4E (0.47) | ALDH1A1HPGDTP53KDM4EGLA | |
| SCHEMBL9330078 | 0.77 | TSHR (0.32) | KMT2ASMN1; SMN2TRPV4 | |
| SCHEMBL25986464 | 0.75 | KCNMA1 (0.33) | ALDH1A1HPGDTP53KDM4EGLA | |
| SCHEMBL25986020 | 0.75 | AR (0.38) | ALDH1A1HPGDTP53KDM4EGLA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0459196-B1 | Fluoromethylated polycyanobenzenes, their addition compounds with alkalicyanides, process for their preparation and utilisation of the fluoromethylated polycyanobenzenes | BAYER AG (DE) | 1994-03-30 | — | — | EP | disclosed |
| US-5175336-A | For detection of anions by visible coloration or fluorescence | BAYER AKTIENGESELLSCHAFT (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0459196-A1 | Fluoromethylated polycyanobenzenes, their addition compounds with alkalicyanides, process for their preparation and utilisation of the fluoromethylated polycyanobenzenes | BAYER AG (DE) | 1991-12-04 | — | — | EP | disclosed |