Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.40 |
| ▸ | LDHB | P07195 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8053837 | 0.79 | RPS6KB1 (0.47) | RPS6KB1LDHALDHBJAK2JAK1 | |
| SCHEMBL8057106 | 0.78 | RPS6KB1 (0.47) | RPS6KB1LDHALDHBJAK2JAK1 | |
| SCHEMBL8051613 | 0.76 | RPS6KB1 (0.45) | RPS6KB1LDHALDHBJAK3CSF1R | |
| SCHEMBL4958934 | 0.70 | RIPK1 (0.35) | OPRK1RIPK1MAPK1ALDH1A1NPSR1 | |
| SCHEMBL10256310 | 0.67 | RPS6KB1 (1.00) | RPS6KB1 | |
| SCHEMBL666702 | 0.67 | RPS6KB1 (1.00) | RPS6KB1 | |
| SCHEMBL1609224 | 0.64 | PDE10A (0.43) | RPS6KB1LDHALDHBOPRK1P2RX7 | |
| SCHEMBL15354441 | 0.63 | MAP4K4 (0.46) | JAK2EGFRALDH1A1NPSR1 | |
| SCHEMBL11153637 | 0.62 | NPC1 (0.56) | MAPK1ALDH1A1 | |
| SCHEMBL15889091 | 0.62 | MAP4K4 (0.39) | EGFRALDH1A1NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999045016-A9 | NOVEL PRODRUGS FOR PHOSPHORUS-CONTAINING COMPOUNDS | METABASIS THERAPEUTICS INC (US) | 2000-03-02 | — | — | WO | disclosed |