Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 1.00 |
| ▸ | ERCC5 | P28715 | 9/20 | 0.55 |
| ▸ | FEN1 | P39748 | 9/20 | 0.55 |
| ▸ | SNCA | P37840 | 1/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6947914 | 0.91 | PTPN1 (0.83) | PTPN1ERCC5FEN1SNCAHAO1 | |
| SCHEMBL6947076 | 0.87 | PTPN1 (0.77) | PTPN1ERCC5FEN1SNCAHAO1 | |
| SCHEMBL6948227 | 0.87 | PTPN1 (0.77) | PTPN1ERCC5FEN1SNCAHAO1 | |
| SCHEMBL6946155 | 0.86 | PTPN1 (0.76) | PTPN1ERCC5FEN1HAO1MRGPRX4 | |
| SCHEMBL6943744 | 0.86 | PTPN1 (0.75) | PTPN1ERCC5FEN1SNCAHAO1 | |
| SCHEMBL6943340 | 0.85 | PTPN1 (0.74) | PTPN1ERCC5FEN1HAO1KDM4E | |
| SCHEMBL7665038 | 0.85 | PTPN1 (0.74) | PTPN1ERCC5FEN1HAO1ALDH1A1 | |
| SCHEMBL6945660 | 0.84 | PTPN1 (0.73) | PTPN1ERCC5FEN1SNCAHAO1 | |
| SCHEMBL6940911 | 0.84 | PTPN1 (0.72) | PTPN1ERCC5FEN1HAO1KDM4E | |
| SCHEMBL6951914 | 0.84 | PTPN1 (0.72) | PTPN1ERCC5FEN1HAO1ALDH1A1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | claimed |
| EP-1082121-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2003-02-05 | — | — | EP | disclosed |
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | disclosed |
| EP-1082121-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999062520-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | disclosed |