Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MMP1 | P03956 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.45 |
| ▸ | TUBB | P07437 | 1/20 | 0.45 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.45 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.45 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.45 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.45 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.45 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.45 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.45 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.45 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.45 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29009158 | 0.88 | LMNA (0.49) | ALDH1A1KDM4ETP53GAAMEN1 | |
| SCHEMBL29009154 | 0.87 | GAA (0.42) | ALDH1A1CYP2C9CYP2C19KDM4ETP53 | |
| SCHEMBL29009201 | 0.87 | ALDH1A1 (0.49) | ALDH1A1CYP2C9CYP2C19KDM4ETP53 | |
| SCHEMBL29009205 | 0.75 | LMNA (0.48) | ALDH1A1KDM4ETP53GAAMEN1 | |
| SCHEMBL29009182 | 0.75 | CA12 (0.43) | ALDH1A1CYP2C9CYP2C19KDM4ETP53 | |
| SCHEMBL29009203 | 0.72 | MEN1 (0.43) | ALDH1A1KDM4ETP53GAAMEN1 | |
| SCHEMBL28595517 | 0.71 | ALDH1A1 (0.78) | ALDH1A1KDM4ETP53GAAMEN1 | |
| SCHEMBL29009167 | 0.71 | ALOX15 (0.50) | ALDH1A1KDM4EGAACA1CA2 | |
| SCHEMBL10536959 | 0.70 | KDM4E (0.56) | ALDH1A1KDM4ETP53GAAMMP1 | |
| SCHEMBL7690545 | 0.67 | ALDH1A1 (1.00) | ALDH1A1CYP2C9CYP2C19KDM4ETP53 |
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-116217458-A | 2-carbonyl-5-phenylpyrrole compound, preparation method, application and derivative thereof, and pharmaceutical composition | 湖北民族大学 | 2023-06-06 | — | — | CN | disclosed |