Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.64 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.64 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.53 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.53 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.53 |
| ▸ | APAF1 | O14727 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16521568 | 0.87 | ESR1 (0.47) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL22416323 | 0.81 | ESR1 (0.43) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL6440186 | 0.79 | ESR2 (1.00) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL19757498 | 0.79 | ESR1 (0.42) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL16848509 | 0.79 | ESR1 (0.49) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL19757547 | 0.78 | ESR1 (0.40) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL16521607 | 0.78 | POLB (0.62) | ESR1ESR2APAF1POLBALDH1A1 | |
| SCHEMBL21524804 | 0.77 | POLB (0.40) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL19757497 | 0.76 | ESR1 (0.43) | ESR1ESR2GRIA1CACNG8CACNG2 | |
| SCHEMBL9007262 | 0.75 | ESR2 (0.91) | ESR1ESR2GRIA1CACNG8CACNG2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20150053894-A1 | Charge-transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications | Molaire Consulting | 2015-02-26 | — | — | US | disclosed |
| US-20150053894-A1 | Charge-transporting Molecular Glass Mixtures, Luminescent Molecular Glass Mixtures, or Combinations Thereof for Organic Light Emitting Diodes and other Organic Electronics and Photonics Applications | Molaire Consulting | 2015-02-26 | — | — | US | disclosed |