Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | NPBWR1 | P48145 | 2/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.33 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.33 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.33 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.33 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.33 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16175824 | 0.95 | HTR2C (0.37) | AKR1B1NPBWR1HTR2CHTR2BRAF1 | |
| SCHEMBL16166745 | 0.94 | ELOVL6 (0.37) | AKR1B1NPBWR1HTR2CHTR2BKCNQ3 | |
| SCHEMBL16175842 | 0.89 | AKR1B1 (0.36) | AKR1B1KCNQ3KCNQ2KCNQ4KCNMA1 | |
| SCHEMBL16166401 | 0.89 | AKR1B1 (0.40) | AKR1B1HTR2CHTR2B | |
| SCHEMBL16166247 | 0.89 | AKR1B1 (0.40) | AKR1B1HTR2CHTR2B | |
| SCHEMBL16166741 | 0.88 | AKR1B1 (0.37) | AKR1B1HTR2CHTR2B | |
| SCHEMBL16166855 | 0.88 | NPBWR1 (0.39) | AKR1B1NPBWR1HTR2CHTR2BRAF1 | |
| SCHEMBL16175839 | 0.86 | AKR1B1 (0.36) | AKR1B1KCNQ3KCNQ2KCNQ4KCNMA1 | |
| SCHEMBL16166210 | 0.86 | KCNT1 (0.39) | AKR1B1 | |
| SCHEMBL16166681 | 0.85 | AKR1B1 (0.37) | AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014167528-A1 | SPIROPYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF FOR THE TREATMENT OF VIRAL INFECTIONS | NOVARTIS AG (CH) | 2014-10-16 | — | — | WO | disclosed |
| WO-2014167528-A1 | SPIROPYRAZOLOPYRIDINE DERIVATIVES AND USES THEREOF FOR THE TREATMENT OF VIRAL INFECTIONS | NOVARTIS AG (CH) | 2014-10-16 | — | — | WO | disclosed |