Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | TOP2A | P11388 | 1/20 | 0.37 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 4/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.34 |
| ▸ | JAK2 | O60674 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7715090 | 0.81 | NQO2 (0.49) | NQO2TOP2ATOP2BKMT2AMEN1 | |
| SCHEMBL7719307 | 0.80 | NQO2 (0.46) | NQO2CA12CA1CA7CA14 | |
| SCHEMBL7717601 | 0.79 | ALDH1A1 (0.37) | NQO2TOP2ATOP2BKMT2AMEN1 | |
| SCHEMBL7717631 | 0.74 | GAA (0.36) | NQO2TOP2ATOP2BKMT2AMEN1 | |
| SCHEMBL7719470 | 0.71 | KCNQ4 (0.39) | CYP17A1KMT2ACA12CA1CA7 | |
| SCHEMBL27351496 | 0.67 | LCK (0.52) | KMT2AMEN1NPC1GAARAB9A | |
| SCHEMBL7717690 | 0.64 | NQO2 (0.51) | NQO2TOP2ATOP2BKMT2AMEN1 | |
| SCHEMBL24150453 | 0.63 | NQO2 (0.42) | NQO2KMT2AMEN1NPC1GAA | |
| SCHEMBL24150706 | 0.63 | LCK (0.45) | NQO2NPC1RAB9ACA12CA1 | |
| SCHEMBL23028526 | 0.63 | BRD4 (0.46) | NQO2CYP17A1NPSR1ATR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6441017-B1 | Inhibitors of prenyl-protein transferase | MERCK & CO., INC. | 2002-08-27 | — | — | US | disclosed |