Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.35 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6898655 | 1.00 | ALDH1A1 (0.37) | ALDH1A1TSHRHSD17B10MMP1MMP2 | |
| SCHEMBL7402677 | 0.86 | EPHX2 (0.36) | ALDH1A1CYSLTR2CYSLTR1PPARG | |
| SCHEMBL6423170 | 0.84 | ALDH1A1 (0.37) | ALDH1A1HSD17B10MMP1MMP2MMP3 | |
| SCHEMBL6420476 | 0.79 | HSD17B10 (0.43) | ALDH1A1HSD17B10MMP1MMP2MMP3 | |
| SCHEMBL2784963 | 0.78 | MMP1 (0.42) | ALDH1A1HSD17B10MMP1MMP2MMP3 | |
| SCHEMBL2803839 | 0.77 | ALDH1A1 (0.39) | ALDH1A1HSD17B10MMP1MMP2MMP3 | |
| SCHEMBL7373232 | 0.74 | TSHR (0.39) | ALDH1A1TSHRHSD17B10MTNR1AMTNR1B | |
| SCHEMBL7373236 | 0.74 | TSHR (0.39) | ALDH1A1TSHRHSD17B10MTNR1AMTNR1B | |
| SCHEMBL6418597 | 0.73 | EPHX2 (0.35) | ALDH1A1HSD17B10MMP1MMP2MMP3 | |
| SCHEMBL6420432 | 0.72 | EPHX2 (0.41) | ALDH1A1PPARGCYP1A2CYP2C9 |
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-1017387-A4 | VITRONECTIN RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM CORP (US) | 2004-08-18 | — | — | EP | disclosed |
| EP-1017387-A1 | VITRONECTIN RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM CORPORATION (US) | 2000-07-12 | — | — | EP | disclosed |
| WO-1999015170-A1 | VITRONECTIN RECEPTOR ANTAGONIST | SMITHKLINE BEECHAM CORPORATION (US) | 1999-04-01 | — | — | WO | disclosed |