Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | MAP3K5 | Q99683 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.31 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.31 |
| ▸ | CACNG2 | Q9Y698 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22416323 | 0.91 | ESR1 (0.43) | ESR1ESR2POLBTYMSKDM4E | |
| SCHEMBL21524804 | 0.88 | POLB (0.40) | ESR1ESR2POLBTYMSKDM4E | |
| SCHEMBL22416325 | 0.81 | POLB (0.36) | ESR1ESR2POLBTYMSALDH1A1 | |
| SCHEMBL21524842 | 0.77 | POLB (0.32) | ESR1ESR2POLB | |
| SCHEMBL22416194 | 0.77 | PDE6D (0.38) | ESR1ESR2KDM4EALDH1A1HPGD | |
| SCHEMBL21524805 | 0.75 | ESR1 (0.38) | ESR1ESR2POLBTYMSKDM4E | |
| SCHEMBL22416321 | 0.74 | PDE6D (0.35) | ESR1ESR2POLBKDM4EALDH1A1 | |
| SCHEMBL16521597 | 0.74 | ESR1 (0.64) | ESR1ESR2POLBKDM4EALDH1A1 | |
| SCHEMBL16848509 | 0.74 | ESR1 (0.49) | ESR1ESR2POLBTYMSKDM4E | |
| SCHEMBL21524812 | 0.72 | PDE6D (0.36) | ESR1ESR2KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-10461269-B2 | Crosslinkable, /polymerizable and combinations thereof charge-transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof for organic light emitting diodes and other organic electronics and photonics applications and method of making same | MOLECULAR GLASSES, INC. (US) | 2019-10-29 | — | — | US | disclosed |