Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 14/20 | 0.54 |
| ▸ | DAO | P14920 | 1/20 | 0.45 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Isoquinoline SCHEMBL27714913 | 0.90 | CA2 (0.49) | NAMPTAKR1B1CA2HTR6 | |
| SCHEMBL10971976 | 0.85 | NAMPT (0.46) | NAMPTDAOHTR6 | |
| SCHEMBL3237494 | 0.80 | CA2 (0.62) | DAOAKR1B1CA2HTR6 | |
| SCHEMBL31561597 | 0.80 | CA2 (0.62) | DAOAKR1B1CA2HTR6 | |
| Quinoline SCHEMBL28873764 | 0.74 | CA2 (0.48) | NAMPTAKR1B1CA2HTR6 | |
| SCHEMBL6988614 | 0.74 | MET (0.49) | NAMPTDAOHTR6 | |
| SCHEMBL6618503 | 0.74 | CA2 (0.46) | AKR1B1CA2CYP2C9HTR6 | |
| SCHEMBL694332 | 0.74 | CA2 (0.42) | AKR1B1CA2HTR6 | |
| SCHEMBL8120975 | 0.74 | KDM4E (0.49) | DAOCA2CYP2C9HTR6 | |
| SCHEMBL7407839 | 0.74 | CNR1 (0.54) | AKR1B1CA2HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-5079363-A | From an alkoxypyridine and an indole derivative, antitumor and antileukemia agents | SANOFI (FR) | 1992-01-07 | — | — | US | disclosed |