Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 8/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.36 |
| ▸ | SELE | P16581 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 4/20 | 0.34 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7859856 | 0.85 | KLK7 (0.37) | ABCB1KLK7GPR119ICAM1SELE | |
| SCHEMBL7859855 | 0.83 | ABCB1 (0.38) | ABCB1GPR119NR1H2NR1H3 | |
| SCHEMBL7859886 | 0.82 | NR1H2 (0.46) | ABCB1KLK7PARP1NR1H2NR1H3 | |
| SCHEMBL7862618 | 0.82 | GPR119 (0.42) | ABCB1GPR119PARP1NR1H2NR1H3 | |
| SCHEMBL7852779 | 0.79 | KLK7 (0.33) | ABCB1KLK7GPR119ICAM1SELE | |
| SCHEMBL7860696 | 0.79 | KLK7 (0.37) | ABCB1KLK7GPR119ICAM1SELE | |
| SCHEMBL31573221 | 0.79 | PREP (0.40) | ABCB1KLK7PARP1 | |
| SCHEMBL7859533 | 0.77 | ABCB1 (0.40) | ABCB1PARP1PRMT5NR1H2NR1H3 | |
| SCHEMBL7853709 | 0.76 | ABCB1 (0.40) | ABCB1PARP1NR1H2NR1H3 | |
| SCHEMBL9399251 | 0.75 | TSHR (0.33) | — |
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-0747381-B1 | CARBAPENEM DERIVATIVE | BANYU PHARMA CO LTD (JP) | 2001-10-31 | — | — | EP | disclosed |
| US-5707987-A | BACTERICIDE ANTIBIOTICS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1998-01-13 | — | — | US | disclosed |
| EP-0747381-A1 | CARBAPENEM DERIVATIVE | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-12-11 | — | — | EP | disclosed |