Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.56 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.48 |
| ▸ | THPO | P40225 | 2/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.48 |
| ▸ | GMNN | O75496 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Butyric Acid SCHEMBL7166690 | 0.89 | EGFR (0.57) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| Acetic Acid SCHEMBL20565475 | 0.83 | EGFR (0.66) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL10473426 | 0.81 | EGFR (0.54) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL121635 | 0.78 | EGFR (0.58) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL1438703 | 0.78 | EGFR (0.55) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| Butyl Alcohol SCHEMBL28279583 | 0.77 | EGFR (0.51) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL9750930 | 0.76 | TP53 (0.56) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL17333728 | 0.75 | TP53 (0.81) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 | |
| SCHEMBL2113709 | 0.75 | EGFR (0.65) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| Acetamide SCHEMBL9819671 | 0.75 | EGFR (0.54) | EGFRERBB2TP53ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994003434-A1 | IMIDAZOLE-CONTAINING ANALOGS OF DISTAMYCIN | RESEARCH CORPORATION TECHNOLOGIES, INC. (US) | 1994-02-17 | — | — | WO | disclosed |