Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.38 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14332177 | 0.85 | HDAC4 (0.40) | HDAC4HDAC2HDAC8GSTP1ESR2 | |
| SCHEMBL29598333 | 0.77 | ALDH1A1 (0.39) | HDAC4HDAC2HDAC8SMN1; SMN2KDM4E | |
| SCHEMBL170839 | 0.77 | ALDH1A1 (0.39) | HDAC4HDAC2HDAC8SMN1; SMN2KDM4E | |
| SCHEMBL6198719 | 0.76 | ALDH1A1 (0.43) | SMN1; SMN2KDM4ENPC1ALDH1A1MAPT | |
| SCHEMBL9441562 | 0.74 | CYP3A4 (0.54) | SMN1; SMN2NPC1NFKB1RAB9ANFKB2 | |
| SCHEMBL14259333 | 0.74 | CYP3A4 (0.57) | HDAC4HDAC2HDAC8SMN1; SMN2KDM4E | |
| SCHEMBL29700245 | 0.74 | CHRNB4 (0.36) | CYP17A1CYP3A4 | |
| SCHEMBL9329744 | 0.74 | HSD17B1 (0.44) | ESR2ESR1HSD17B1HSD17B2KDM4E | |
| SCHEMBL6642876 | 0.73 | HTR1A (0.47) | NPC1MAPTRAB9AMAOBCYP1A2 | |
| SCHEMBL9873789 | 0.73 | MAPT (0.39) | SMN1; SMN2KDM4ENPC1ALDH1A1MAPT |
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-104822697-A | Bridged metallocene compounds, catalyst systems and polymerization processes using the same | EXXONMOBIL CHEM PATENTS INC | 2015-08-05 | — | — | CN | disclosed |