Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAO1 | Q9UJM8 | 4/20 | 0.48 |
| ▸ | ERCC5 | P28715 | 7/20 | 0.46 |
| ▸ | FEN1 | P39748 | 7/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6947604 | 0.86 | ERCC5 (0.61) | HAO1ERCC5FEN1PTPN1 | |
| SCHEMBL6949748 | 0.77 | ERCC5 (0.53) | HAO1ERCC5FEN1PTPN1 | |
| SCHEMBL6940911 | 0.76 | PTPN1 (0.72) | HAO1ERCC5FEN1PTPN1MAPT | |
| SCHEMBL7073904 | 0.75 | TBXAS1 (0.52) | ERCC5FEN1PTPN1 | |
| SCHEMBL6949384 | 0.74 | ERCC5 (0.46) | HAO1ERCC5FEN1PTPN1MAPT | |
| SCHEMBL6948238 | 0.74 | PTPN1 (0.44) | HAO1ERCC5FEN1PTPN1 | |
| SCHEMBL6946034 | 0.74 | PTPN1 (0.53) | HAO1ERCC5FEN1PTPN1HDAC1 | |
| SCHEMBL6947067 | 0.74 | PTPN1 (0.53) | HAO1ERCC5FEN1PTPN1MAPT | |
| Dimethylamine SCHEMBL6946035 | 0.74 | PTPN1 (0.68) | HAO1ERCC5FEN1PTPN1 | |
| SCHEMBL7671810 | 0.73 | CYP19A1 (0.46) | HAO1ERCC5FEN1PTPN1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1082121-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2003-02-05 | — | — | EP | claimed |
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | claimed |
| EP-1082121-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2001-03-14 | — | — | EP | claimed |
| WO-1999062520-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | 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 |