Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.42 |
| ▸ | CCR1 | P32246 | 1/20 | 0.42 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.42 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.38 |
| ▸ | FEN1 | P39748 | 2/20 | 0.38 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | LIPE | Q05469 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | USP1 | O94782 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.32 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9979025 | 0.81 | KCNE1 (0.51) | KCNE1CCR1KCNQ1ERCC1FEN1 | |
| SCHEMBL6646417 | 0.77 | GAA (0.40) | ERCC1FEN1ERCC4RAB9ALIPE | |
| SCHEMBL6645445 | 0.72 | TDP1 (0.50) | TP53RAB9AUSP1TDP1 | |
| SCHEMBL6645871 | 0.71 | TDP1 (0.44) | TP53USP1TDP1 | |
| SCHEMBL6649244 | 0.69 | RNASEH1 (0.40) | RAB9ATDP1 | |
| SCHEMBL6646945 | 0.69 | ERCC1 (0.50) | ERCC1FEN1ERCC4 | |
| SCHEMBL6883598 | 0.69 | TNKS (0.43) | ERCC1FEN1ERCC4 | |
| SCHEMBL6885410 | 0.68 | PIN1 (0.60) | MAPTERCC1FEN1ERCC4TDP1 | |
| SCHEMBL6649378 | 0.68 | ERCC1 (0.58) | ERCC1FEN1ERCC4 | |
| SCHEMBL6651415 | 0.68 | RIPK1 (0.43) | TP53ERCC1FEN1ERCC4RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1819700-A2 | POTASSIUM SALT OF AN HIV INTERGRASE INHIBITOR | Merck & Co., Inc. (US) | 2007-08-22 | — | — | EP | disclosed |
| WO-2006060712-A9 | POTASSIUM SALT OF AN HIV INTEGRASE INHIBITOR | MERCK & CO INC (US) | 2006-07-27 | — | — | WO | disclosed |
| WO-2006060712-A2 | POTASSIUM SALT OF AN HIV INTEGRASE INHIBITOR | MERCK & CO. INC. (US) | 2006-06-08 | — | — | WO | disclosed |