Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.53 |
| ▸ | CCND1 | P24385 | 4/20 | 0.53 |
| ▸ | BRD4 | O60885 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | GABRA5 | P31644 | 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 | |
|---|---|---|---|---|
| SCHEMBL11225244 | 1.00 | CDK4 (0.53) | CDK4CCND1BRD4KMT2ASLC2A1 | |
| SCHEMBL13416068 | 0.84 | CDK4 (0.59) | CDK4CCND1KMT2AHTR6PLAU | |
| SCHEMBL12542891 | 0.83 | CDK4 (0.59) | CDK4CCND1HTR2AHTR2C | |
| SCHEMBL28690469 | 0.82 | CDK4 (0.49) | CDK4CCND1KMT2AHTR6PLAU | |
| SCHEMBL916444 | 0.82 | BRD4 (0.56) | BRD4SLC2A1HTR6CYP1A2CYP2C9 | |
| SCHEMBL31661504 | 0.82 | SLC2A1 (0.54) | BRD4SLC2A1HTR6CYP1A2CYP2C9 | |
| SCHEMBL3507524 | 0.82 | SLC2A1 (0.54) | BRD4SLC2A1HTR6CYP1A2CYP2C9 | |
| SCHEMBL4035941 | 0.82 | SLC2A1 (0.45) | BRD4KMT2ASLC2A1CYP1A2CYP2C9 | |
| SCHEMBL17067797 | 0.82 | BRD4 (0.56) | BRD4SLC2A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL28572469 | 0.78 | BRD4 (0.47) | BRD4SLC2A1HTR6CYP1A2CYP2C9 |
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-113004188-B | Indole derivative, preparation method and application | 沈阳药科大学 | 2022-09-20 | — | — | CN | disclosed |