Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | FBP1 | P09467 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21350754 | 0.85 | CYP4F2 (0.47) | CCNCCDK8ALDH1A1MAPTLMNA | |
| SCHEMBL21331853 | 0.84 | CCNC (0.46) | CCNCCDK8SLC22A12FFAR1TBXAS1 | |
| SCHEMBL21331867 | 0.82 | CCNC (0.44) | CCNCCDK8SLC22A12TBXAS1 | |
| SCHEMBL21333890 | 0.82 | CCNC (0.44) | CCNCCDK8SLC22A12FFAR1TBXAS1 | |
| SCHEMBL21350908 | 0.82 | CCNC (0.44) | CCNCCDK8SLC22A12FFAR1TBXAS1 | |
| SCHEMBL21331873 | 0.82 | SLC22A12 (0.50) | CCNCCDK8MAPTSLC22A12TBXAS1 | |
| SCHEMBL28415065 | 0.80 | SLC22A12 (0.61) | CCNCCDK8SLC22A12 | |
| SCHEMBL21350520 | 0.79 | CCNC (0.52) | CCNCCDK8ALDH1A1TDP1FFAR1 | |
| SCHEMBL21331862 | 0.79 | SLC22A12 (0.51) | CCNCCDK8SLC22A12TBXAS1CYP2C9 | |
| SCHEMBL21333884 | 0.79 | SLC22A12 (0.53) | CCNCCDK8SLC22A12TBXAS1CYP2D6 |
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 |