Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | PAM | P19021 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL9798232 | 0.79 | ALDH1A1 (0.39) | ALDH1A1TSHRTRPA1MAOBCYP2A6 | |
| SCHEMBL25245587 | 0.76 | MAOB (0.44) | ALDH1A1TRPA1MAOBIDO1LMNA | |
| SCHEMBL790911 | 0.75 | ALDH1A1 (0.36) | ALDH1A1TSHRMAOBCYP2A6IDO1 | |
| SCHEMBL29135403 | 0.75 | IDO1 (0.36) | ALDH1A1TSHRTRPA1MAOBCYP2A6 | |
| SCHEMBL7054866 | 0.75 | ALDH1A1 (0.36) | ALDH1A1TSHRTRPA1MAOBCYP2A6 | |
| SCHEMBL2769032 | 0.75 | ALDH1A1 (0.36) | ALDH1A1TSHRTRPA1MAOBCYP2A6 | |
| SCHEMBL93706 | 0.75 | RELA (0.47) | ALDH1A1TSHRTRPA1MAOBCYP2A6 | |
| SCHEMBL425560 | 0.73 | TSHR (0.50) | ALDH1A1TSHRMAOBIDO1LMNA | |
| SCHEMBL635906 | 0.71 | TAAR1 (0.46) | ALDH1A1TSHRCYP2A6IDO1TDP1 | |
| SCHEMBL5410674 | 0.71 | TRPA1 (0.39) | ALDH1A1TSHRTRPA1MAOBIDO1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0354788-B1 | Novel imidazole derivatives | NIPPON CHEMIPHAR CO (JP) | 1995-09-13 | — | — | EP | disclosed |
| US-5180836-A | Antiulcer agents | NIPPON CHEMIPHAR CO., LTD. (JP) | 1993-01-19 | — | — | US | disclosed |
| US-5082943-A | Antiulcer | NIPPON CHEMIPHAR CO., LTD. (JP) | 1992-01-21 | — | — | US | disclosed |
| EP-0354788-A1 | Novel imidazole derivatives | NIPPON CHEMIPHAR CO., LTD. (JP) | 1990-02-14 | — | — | EP | disclosed |
| US-4678792-A | ANTITHROMBIC AGENTS | DR. KARL THOMAE GMBH (DE) | 1987-07-07 | — | — | US | disclosed |
| EP-0154842-A2 | Medicament containing quaternary 3,4-dihydroisoquinoline salts | Dr. Karl Thomae GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |