Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGPAT2 | O15120 | 17/20 | 0.57 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21953110 | 0.89 | AGPAT2 (0.59) | AGPAT2TP53MAPT | |
| SCHEMBL4288850 | 0.80 | AGPAT2 (0.74) | AGPAT2TP53MAPTNPC1CYP1A2 | |
| SCHEMBL4279343 | 0.76 | AGPAT2 (0.77) | AGPAT2TP53MAPTLMNAPOLB | |
| SCHEMBL13880171 | 0.73 | AGPAT2 (1.00) | AGPAT2NPC1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL25039650 | 0.73 | AGPAT2 (0.53) | AGPAT2TP53MAPTLMNAPOLB | |
| SCHEMBL4287579 | 0.72 | AGPAT2 (0.62) | AGPAT2TP53MAPTNPC1RAB9A | |
| SCHEMBL13880169 | 0.71 | AGPAT2 (0.90) | AGPAT2NPC1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13880176 | 0.69 | AGPAT2 (1.00) | AGPAT2MAPTNPC1CYP1A2CYP3A4 | |
| SCHEMBL13880262 | 0.69 | AGPAT2 (0.88) | AGPAT2NPC1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13892055 | 0.68 | AGPAT2 (0.77) | AGPAT2NPC1CYP1A2CYP3A4CYP2C19 |
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-2020080979-A1 | PFKFB3 INHIBITORS AND THEIR USES | GERO DISCOVERY LIMITED LIABILITY COMPANY (RU) | 2020-04-23 | — | — | WO | disclosed |