Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 3/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.34 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20548123 | 1.00 | ALDH1A1 (0.46) | ALDH1A1MRGPRX4CYP4F2CYP4A11TP53 | |
| SCHEMBL20485056 | 0.90 | TSHR (0.42) | ALDH1A1MRGPRX4CYP4F2CYP4A11TSHR | |
| SCHEMBL21657589 | 0.89 | CTSD (0.38) | ALDH1A1SMN1; SMN2TSHRIDO1 | |
| SCHEMBL649159 | 0.86 | TSHR (0.46) | MRGPRX4TP53PKMNFKB1NFKB2 | |
| SCHEMBL21169086 | 0.86 | KDM4E (0.39) | ALDH1A1CYP4F2CYP4A11SMN1; SMN2TSHR | |
| SCHEMBL29928701 | 0.85 | MRGPRX4 (0.46) | MRGPRX4CYP4F2CYP4A11TP53PKM | |
| SCHEMBL20547932 | 0.85 | MRGPRX4 (0.46) | MRGPRX4CYP4F2CYP4A11TP53PKM | |
| SCHEMBL19889624 | 0.82 | TSHR (0.47) | ALDH1A1CYP4F2CYP4A11SMN1; SMN2TSHR | |
| SCHEMBL29200252 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11 | |
| SCHEMBL30771521 | 0.82 | CYP4F2 (0.55) | CYP4F2CYP4A11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112638477-B | Pyrrolo [2,3-B ] pyridine derivatives as inhibitors of influenza virus replication | 共晶制药公司 | 2024-01-26 | — | — | CN | disclosed |
| CN-110637022-B | Pyrrolopyrimidine derivatives as inhibitors of influenza virus replication | 共晶制药公司 | 2022-09-16 | — | — | CN | disclosed |