Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.43 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA9 | Q16790 | 4/20 | 0.43 |
| ▸ | PREP | P48147 | 4/20 | 0.40 |
| ▸ | GABRP | O00591 | 2/20 | 0.39 |
| ▸ | GABRD | O14764 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.39 |
| ▸ | GABRE | P78334 | 2/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.39 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.39 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28613347 | 0.90 | CA12 (0.43) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL7257494 | 0.88 | HPSE (0.47) | CA12CA1CA9GABRPGABRD | |
| SCHEMBL4753702 | 0.82 | CA12 (0.46) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL1604135 | 0.79 | CA12 (0.43) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL29053391 | 0.79 | CA12 (0.46) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL7301972 | 0.79 | CA12 (0.46) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL14110450 | 0.78 | CA12 (0.48) | CA12CA1CA9PREPGABRA1 | |
| SCHEMBL24420805 | 0.78 | CA12 (0.43) | CA12CA1CA9PREPALDH1A1 | |
| SCHEMBL5509632 | 0.78 | CA12 (0.43) | CA12CA1CA9PREPKDM4E | |
| SCHEMBL6211617 | 0.78 | KDM4E (0.47) | CA12CA1CA9PREPKDM4E |
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-0550924-A1 | 2-Pyrrolidinone derivatives as HIV protease inhibitors | MERCK & CO. INC. (US) | 1993-07-14 | — | — | EP | disclosed |