Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | STAT1 | P42224 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | SI | P14410 | 3/20 | 0.33 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11328891 | 0.94 | STAT3 (0.39) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL11568376 | 0.92 | STAT3 (0.38) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL11315720 | 0.92 | STAT3 (0.38) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL28513504 | 0.92 | STAT3 (0.38) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL28489793 | 0.92 | STAT3 (0.38) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL11313167 | 0.92 | STAT3 (0.38) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| Toluene SCHEMBL28139713 | 0.91 | STAT3 (0.37) | ALDH1A1STAT3STAT1KDM4ECYP1A2 | |
| SCHEMBL5487566 | 0.87 | NPC1 (0.42) | ALDH1A1STAT3STAT1HPGDNPC1 | |
| SCHEMBL9298253 | 0.85 | GSK3B (0.42) | STAT3STAT1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL28838451 | 0.82 | STAT3 (0.36) | STAT3STAT1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104557948-B | Method for preparing monodispersed porphyrin molecule particles by water droplet templating method | 中国科学院化学研究所 | 2017-04-12 | — | — | CN | disclosed |