Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 4/20 | 0.61 |
| ▸ | GAA | P10253 | 2/20 | 0.61 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.56 |
| ▸ | KDR | P35968 | 9/20 | 0.54 |
| ▸ | KIT | P10721 | 7/20 | 0.54 |
| ▸ | FLT3 | P36888 | 6/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.51 |
| ▸ | JAK2 | O60674 | 4/20 | 0.51 |
| ▸ | LCK | P06239 | 3/20 | 0.51 |
| ▸ | CSF1R | P07333 | 3/20 | 0.51 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.51 |
| ▸ | PRKACA | P17612 | 3/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.51 |
| ▸ | PLK4 | O00444 | 2/20 | 0.51 |
| ▸ | AURKA | O14965 | 2/20 | 0.51 |
| ▸ | CDK1 | P06493 | 2/20 | 0.51 |
| ▸ | LYN | P07948 | 2/20 | 0.51 |
| ▸ | SRC | P12931 | 2/20 | 0.51 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL628649 | 0.79 | PDPK1 (0.66) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL30065304 | 0.79 | PDPK1 (0.66) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL569660 | 0.76 | GAA (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL186280 | 0.76 | GAA (1.00) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL30248298 | 0.76 | GAA (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL185907 | 0.76 | GAA (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL12928484 | 0.76 | PDPK1 (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL10368038 | 0.76 | PDPK1 (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL760018 | 0.76 | PDPK1 (0.61) | PDPK1GAAMAP2K1KDRKIT | |
| SCHEMBL30566149 | 0.76 | PDPK1 (0.61) | PDPK1GAAMAP2K1KDRKIT |
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 |
|---|---|---|---|---|---|---|---|
| US-RE37781-E1 | VIRICIDES, PROTEASE INHIBITOR | DUPONT PHARMACEUTICALS COMPANY | 2002-07-02 | — | — | US | claimed |
| US-5877170-A | VIRICIDES | DUPONT PHARMACEUTICALS COMPANY (US) | 1999-03-02 | — | — | US | claimed |
| US-5610294-A | VIRAL TREATMENT | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1997-03-11 | — | — | US | claimed |