Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 9/20 | 0.57 |
| ▸ | ERCC5 | P28715 | 8/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.53 |
| ▸ | HAO1 | Q9UJM8 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7665649 | 0.84 | ERCC5 (0.56) | FEN1ERCC5PTPN1HAO1HDAC1 | |
| SCHEMBL7662930 | 0.79 | CYP11B1 (0.58) | PTPN1HDAC1HDAC6SMN1; SMN2 | |
| SCHEMBL7667737 | 0.79 | GRM2 (0.57) | FEN1ERCC5PTPN1NPC1RAB9A | |
| SCHEMBL6940911 | 0.77 | PTPN1 (0.72) | FEN1ERCC5PTPN1HAO1SMN1; SMN2 | |
| SCHEMBL7196671 | 0.77 | ERCC5 (0.66) | FEN1ERCC5PTPN1HAO1NPC1 | |
| SCHEMBL6947108 | 0.76 | GAA (0.52) | FEN1ERCC5PTPN1RAB9ASMN1; SMN2 | |
| Dimethylamine SCHEMBL6946035 | 0.75 | PTPN1 (0.68) | FEN1ERCC5PTPN1HAO1 | |
| SCHEMBL6947650 | 0.72 | PTPN1 (0.72) | FEN1ERCC5PTPN1HAO1NPC1 | |
| SCHEMBL7671810 | 0.72 | CYP19A1 (0.46) | FEN1ERCC5PTPN1HAO1 | |
| SCHEMBL6946229 | 0.71 | PTPN1 (0.84) | FEN1ERCC5PTPN1RAB9ASMN1; SMN2 |
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 |