Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SLC40A1 | Q9NP59 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14224300 | 0.82 | SLC40A1 (0.48) | NCF1CCR1CCR5CCR8NOS3 | |
| SCHEMBL24363088 | 0.80 | TOP1 (0.41) | NCF1CCR1CCR5CCR8CYP3A4 | |
| SCHEMBL29631939 | 0.80 | TOP1 (0.41) | NCF1CCR1CCR5CCR8CYP3A4 | |
| SCHEMBL19864754 | 0.79 | PSMD14 (0.37) | NCF1CCR1CCR5CCR8AR | |
| SCHEMBL18980694 | 0.77 | NOTUM (0.35) | NCF1CYP1A2CYP3A4ALOX15TSHR | |
| SCHEMBL26439743 | 0.77 | NCF1 (0.33) | NCF1CYP1A2CYP3A4ALOX15TSHR | |
| SCHEMBL29722314 | 0.77 | NOTUM (0.35) | NCF1CYP1A2CYP3A4ALOX15TSHR | |
| SCHEMBL7757756 | 0.76 | NCF1 (0.55) | NCF1SLC40A1PARP1NR1H2NR1H3 | |
| SCHEMBL30547062 | 0.75 | DHODH (0.35) | NCF1NOS3NOS2ARCYP1A2 | |
| SCHEMBL4383170 | 0.75 | DHODH (0.35) | NCF1NOS3NOS2ARCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106083845-A | A kind of 1,5 naphthyridine type luminous organic material compounds and synthetic method thereof and application | 金陵科技学院 | 2016-11-09 | — | — | CN | claimed |
| CN-106083845-A | A kind of 1,5 naphthyridine type luminous organic material compounds and synthetic method thereof and application | 金陵科技学院 | 2016-11-09 | — | — | CN | disclosed |