Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 2/20 | 0.46 |
| ▸ | CDK8 | P49336 | 2/20 | 0.46 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 8/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21333890 | 0.90 | CCNC (0.44) | CCNCCDK8SLC22A12TBXAS1PARP1 | |
| SCHEMBL21331867 | 0.87 | CCNC (0.44) | CCNCCDK8SLC22A12TBXAS1PARP1 | |
| SCHEMBL21350908 | 0.87 | CCNC (0.44) | CCNCCDK8SLC22A12TBXAS1PARP1 | |
| SCHEMBL21331873 | 0.87 | SLC22A12 (0.50) | CCNCCDK8SLC22A12TBXAS1PARP1 | |
| SCHEMBL21331852 | 0.87 | CYP2C9 (0.54) | CCNCCDK8SLC22A12KEAP1NFE2L2 | |
| SCHEMBL21331862 | 0.87 | SLC22A12 (0.51) | CCNCCDK8SLC22A12TBXAS1PARP1 | |
| SCHEMBL21350638 | 0.85 | CYP4F2 (0.54) | CCNCCDK8SLC22A12TBXAS1CYP2C9 | |
| SCHEMBL28415065 | 0.85 | SLC22A12 (0.61) | CCNCCDK8SLC22A12 | |
| SCHEMBL21350520 | 0.84 | CCNC (0.52) | CCNCCDK8TBXAS1FTOFFAR1 | |
| SCHEMBL21333884 | 0.84 | SLC22A12 (0.53) | CCNCCDK8SLC22A12TBXAS1PARP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019169890-A1 | 3-(NAPHTHALENE-1-METHYL SUBSTITUTED)PYRIDINE DERIVATIVE, SYNTHETIC METHOD THEREFOR AND USE THEREOF | 南方医科大学 | 2019-09-12 | — | — | WO | claimed |
| CN-108440397-B | 3- (naphthalene-1-methyl substituted) pyridine derivative and synthesis method and application thereof | 南方医科大学 | 2020-06-05 | — | — | CN | disclosed |
| WO-2019169890-A1 | 3-(NAPHTHALENE-1-METHYL SUBSTITUTED)PYRIDINE DERIVATIVE, SYNTHETIC METHOD THEREFOR AND USE THEREOF | 南方医科大学 | 2019-09-12 | — | — | WO | disclosed |