Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.30 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.30 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.30 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.30 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9641347 | 0.79 | CYP1A2 (0.32) | MAPTCYP1A2CYP2C9HPGDMAPK1 | |
| SCHEMBL12557935 | 0.79 | — | — | |
| SCHEMBL13090189 | 0.79 | — | — | |
| SCHEMBL469151 | 0.79 | — | — | |
| SCHEMBL1250787 | 0.78 | CHRNB2 (0.40) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| Trolamine SCHEMBL28239093 | 0.77 | MAPT (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| Trolamine SCHEMBL10425247 | 0.77 | TSHR (0.56) | MAPTCYP1A2CYP2C9HPGDMAPK1 | |
| Hydrochloric Acid SCHEMBL22575507 | 0.76 | — | — | |
| Water SCHEMBL28162043 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL4622688 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-115260827-B | Colorant suitable for water-based ink, preparation method of colorant and water-based ink containing colorant | 中国科学院理化技术研究所 | 2023-05-12 | — | — | CN | disclosed |
| CN-115260827-A | Colorant suitable for water-based ink, preparation method thereof and water-based ink containing colorant | 中国科学院理化技术研究所 | 2022-11-01 | — | — | CN | disclosed |
| CN-114805747-A | Water-based hyperbranched polyurethane colorant, preparation method thereof and application thereof in water-based ink | 中国科学院理化技术研究所 | 2022-07-29 | — | — | CN | disclosed |