Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERCC5 | P28715 | 12/20 | 0.57 |
| ▸ | FEN1 | P39748 | 12/20 | 0.57 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.52 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.46 |
| ▸ | HAO1 | Q9UJM8 | 2/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL7830529 | 0.86 | ERCC5 (0.59) | ERCC5FEN1RNASEH1PTPN1HAO1 | |
| SCHEMBL7830273 | 0.83 | SMN1; SMN2 (0.44) | ERCC5FEN1POLBTDP1MAPT | |
| SCHEMBL7082086 | 0.78 | LMNA (0.58) | DAOPOLBTDP1MAPTRECQL | |
| SCHEMBL17996050 | 0.77 | FAAH (0.49) | DAOL3MBTL1 | |
| SCHEMBL7826555 | 0.75 | FEN1 (0.52) | ERCC5FEN1RNASEH1PTPN1HAO1 | |
| SCHEMBL7828973 | 0.75 | ERCC5 (0.50) | ERCC5FEN1RNASEH1PTPN1POLB | |
| SCHEMBL7077326 | 0.75 | KMT2A (0.36) | ERCC5FEN1DAOPOLBTDP1 | |
| SCHEMBL7830008 | 0.75 | RNASEH1 (0.62) | ERCC5FEN1RNASEH1PTPN1HAO1 | |
| SCHEMBL6951660 | 0.74 | ERCC5 (0.71) | ERCC5FEN1PTPN1HAO1TDP1 | |
| SCHEMBL7828346 | 0.74 | ERCC5 (0.55) | ERCC5FEN1RNASEH1PTPN1HAO1 |
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-1086091-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2001-10-10 | — | — | EP | claimed |
| US-6262055-B1 | SULFUR-CONTAINING HETEROARYL DIOXO-BUTYRIC ACID DERIVATIVES | MERCK & CO., INC. | 2001-07-17 | — | — | US | claimed |
| EP-1086091-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2001-03-28 | — | — | EP | claimed |
| WO-1999062897-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | claimed |
| EP-1086091-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2001-10-10 | — | — | EP | disclosed |
| US-6262055-B1 | SULFUR-CONTAINING HETEROARYL DIOXO-BUTYRIC ACID DERIVATIVES | MERCK & CO., INC. | 2001-07-17 | — | — | US | disclosed |
| EP-1086091-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (a New Jersey corp.) (US) | 2001-03-28 | — | — | EP | disclosed |
| WO-1999062897-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | disclosed |