Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.35 |
| ▸ | BUB1 | O43683 | 2/20 | 0.34 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21350307 | 0.90 | ELANE (0.42) | ELANESLC22A12DGAT2MAPK8MAPK9 | |
| SCHEMBL21331842 | 0.87 | SLC22A12 (0.39) | FFAR1SLC22A12DGAT2MAPK8MAPK9 | |
| SCHEMBL21350518 | 0.87 | CYP2C9 (0.45) | ELANETP53TSHR | |
| SCHEMBL21350629 | 0.85 | PDCD1 (0.42) | ELANESLC22A12DGAT2MAPK8MAPK9 | |
| SCHEMBL21350517 | 0.85 | SLC22A12 (0.52) | ELANESLC22A12 | |
| SCHEMBL21350533 | 0.81 | LATS1 (0.43) | NAMPTFFAR1SLC22A12DGAT2BUB1 | |
| SCHEMBL21350306 | 0.80 | KDM4E (0.37) | NAMPTFFAR1SLC22A12TP53TSHR | |
| SCHEMBL21350623 | 0.80 | SLC22A12 (0.43) | NAMPTFFAR1SLC22A12TSHR | |
| SCHEMBL21333904 | 0.78 | SLC22A12 (0.39) | NAMPTSLC22A12MAPK8MAPK9MAPK10 | |
| SCHEMBL21350909 | 0.76 | CYP4F2 (0.50) | NAMPTFFAR1SLC22A12DGAT2GPBAR1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |