Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 4/20 | 0.46 |
| ▸ | ERCC5 | P28715 | 8/20 | 0.41 |
| ▸ | FEN1 | P39748 | 8/20 | 0.41 |
| ▸ | HAO1 | Q9UJM8 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6946953 | 0.89 | SMN1; SMN2 (0.43) | PTPN1NPC1HPGDRAB9ASMN1; SMN2 | |
| SCHEMBL6951325 | 0.79 | PTPN1 (0.49) | PTPN1ERCC5FEN1HAO1 | |
| SCHEMBL6949523 | 0.77 | PTPN1 (0.53) | PTPN1ERCC5FEN1HAO1NPC1 | |
| SCHEMBL6943754 | 0.73 | PTPN1 (0.56) | PTPN1ERCC5FEN1HAO1NPC1 | |
| SCHEMBL6944426 | 0.73 | PTPN1 (0.67) | PTPN1ERCC5FEN1NPC1HPGD | |
| SCHEMBL6815544 | 0.71 | LMNA (0.57) | NPC1HPGDRAB9ASMN1; SMN2SMPD1 | |
| SCHEMBL6945641 | 0.71 | PTPN1 (0.71) | PTPN1ERCC5FEN1HAO1HDAC1 | |
| SCHEMBL6946238 | 0.70 | PTPN1 (0.53) | PTPN1ERCC5FEN1HAO1THRA | |
| SCHEMBL6948444 | 0.70 | PTPN1 (0.52) | PTPN1ERCC5FEN1HAO1RAB9A | |
| SCHEMBL8993073 | 0.69 | MAPT (0.51) | NPC1HPGDRAB9ASMPD1HDAC1 |
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 4 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 | 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 |