Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.58 |
| ▸ | ACHE | P22303 | 3/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NCF1 | P14598 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21657447 | 1.00 | TAAR1 (0.58) | TAAR1ACHEMAOBTSHRNCF1 | |
| SCHEMBL1047449 | 0.85 | TAAR1 (0.64) | TAAR1ACHEMAOBTSHRKMT2A | |
| SCHEMBL30820845 | 0.85 | TAAR1 (0.68) | TAAR1ACHEMAOBCHRM2CHRM1 | |
| SCHEMBL146849 | 0.85 | TAAR1 (0.68) | TAAR1ACHEMAOBCHRM2CHRM1 | |
| SCHEMBL2911039 | 0.84 | TAAR1 (0.62) | TAAR1ACHEMAOBTSHR | |
| SCHEMBL26985792 | 0.84 | TAAR1 (0.67) | TAAR1ACHEMAOBKDM4E | |
| SCHEMBL25815700 | 0.84 | CNR1 (0.47) | TAAR1TSHRKDM4E | |
| Hydrochloric Acid SCHEMBL21810796 | 0.83 | TAAR1 (0.66) | TAAR1ACHEMAOBCHRM2CHRM1 | |
| SCHEMBL7991368 | 0.83 | TAAR1 (0.60) | TAAR1TSHR | |
| Hydrochloric Acid SCHEMBL3020991 | 0.83 | TAAR1 (0.60) | TAAR1ACHEMAOBTSHR |
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 |