Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ESPL1 | Q14674 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | LIG1 | P18858 | 2/20 | 0.38 |
| ▸ | LIG3 | P49916 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1362507 | 0.84 | TSHR (0.56) | ALDH1A1CYP3A4TSHRLMNAHTT | |
| SCHEMBL16104504 | 0.84 | ALDH1A1 (0.44) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL26089595 | 0.83 | ERN1 (0.50) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL2771759 | 0.80 | ERN1 (0.59) | ERN1ALDH1A1TSHRMAPTLMNA | |
| SCHEMBL11459067 | 0.80 | ERN1 (0.47) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL30329716 | 0.80 | ERN1 (0.59) | ERN1ALDH1A1CYP3A4MAPTLMNA | |
| SCHEMBL31490664 | 0.80 | ERN1 (0.47) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL16457733 | 0.80 | ERN1 (0.47) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL657768 | 0.80 | ERN1 (0.46) | ERN1ALDH1A1CYP3A4TSHRMAPT | |
| SCHEMBL1300350 | 0.80 | ERN1 (0.59) | ERN1ALDH1A1CYP3A4MAPTLMNA |
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-0054180-A2 | Process for the preparation of imidazoquinazoline derivatives | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-06-23 | — | — | EP | disclosed |