Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.44 |
| ▸ | SI | P14410 | 1/20 | 0.44 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | GSK3A | P49840 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL2042195 | 0.98 | — | — | |
| SCHEMBL10671098 | 0.82 | NAAA (0.35) | ALDH1A1LMNATSHRCHRM1 | |
| Isopropyl Isothiocyanate SCHEMBL6896556 | 0.79 | TRPA1 (0.46) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL48624 | 0.78 | — | — | |
| SCHEMBL1457047 | 0.78 | CYP1A2 (0.44) | GAAMGAMSIMGAM2ALDH1A1 | |
| Water SCHEMBL27286505 | 0.77 | GAA (0.46) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL28249809 | 0.77 | — | — | |
| SCHEMBL544155 | 0.76 | — | — | |
| SCHEMBL5709255 | 0.75 | ALDH1A1 (0.44) | GAAMGAMSIMGAM2ALDH1A1 | |
| SCHEMBL3083780 | 0.75 | CYP1A2 (0.50) | GAAMGAMSIMGAM2ALDH1A1 |
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-0194846-B1 | PREPARATION OF THIENO-IMIDAZOLE DERIVATIVES | PFIZER INC. (US) | 1991-05-08 | — | — | EP | disclosed |
| US-4670564-A | Preparation of thieno-imidazole derivatives | PFIZER INC. (US) | 1987-06-02 | — | — | US | disclosed |
| EP-0194846-A2 | Preparation of thieno-imidazole derivatives | PFIZER INC. (US) | 1986-09-17 | — | — | EP | disclosed |