Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F12 | P00748 | 1/20 | 0.57 |
| ▸ | PLAU | P00749 | 1/20 | 0.57 |
| ▸ | NCF1 | P14598 | 1/20 | 0.57 |
| ▸ | NOS3 | P29474 | 1/20 | 0.57 |
| ▸ | NOS1 | P29475 | 1/20 | 0.57 |
| ▸ | NOS2 | P35228 | 1/20 | 0.57 |
| ▸ | BACE1 | P56817 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | IMPDH2 | P12268 | 4/20 | 0.50 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.44 |
| ▸ | CLK1 | P49759 | 4/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL246633 | 1.00 | F12 (0.57) | F12PLAUNCF1NOS3NOS1 | |
| SCHEMBL292215 | 0.84 | F12 (0.59) | F12PLAUNCF1NOS3NOS1 | |
| SCHEMBL29850085 | 0.84 | F12 (0.59) | F12PLAUNCF1NOS3NOS1 | |
| SCHEMBL29421593 | 0.76 | NOS3 (0.54) | F12PLAUNCF1NOS3NOS1 | |
| SCHEMBL3386889 | 0.74 | IMPDH2 (0.50) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL31401046 | 0.74 | IMPDH2 (0.50) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2012410 | 0.74 | KDM4E (0.44) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL245899 | 0.74 | IMPDH2 (0.50) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL277425 | 0.74 | KDM4E (0.53) | LMNACYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL3856487 | 0.74 | ROCK1 (0.61) | F12PLAUNCF1NOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117377671-A | Diacylglycerol kinase modulating compounds | 吉利德科学公司 | 2024-01-09 | — | — | CN | disclosed |