Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MMP2 | P08253 | 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 | |
|---|---|---|---|---|
| SCHEMBL19757549 | 0.94 | HDAC1 (0.32) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL19757547 | 0.91 | ESR1 (0.40) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL19757546 | 0.89 | ESR1 (0.37) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL16521779 | 0.87 | POLB (0.36) | LMNAPSMD14TP53POLBMMP2 | |
| SCHEMBL19757548 | 0.86 | ESR1 (0.37) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL16521690 | 0.80 | — | — | |
| SCHEMBL16521668 | 0.79 | PDE6D (0.30) | — | |
| SCHEMBL16525562 | 0.76 | POLB (0.35) | LMNAPSMD14TP53POLBMMP2 | |
| SCHEMBL19757498 | 0.72 | ESR1 (0.42) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL16525566 | 0.72 | — | — |
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-9859505-B2 | Charge-transporting molecular glass mixtures, luminescent molecular glass mixtures, or combinations thereof or organic light emitting diodes and other organic electronics and photonics applications | MOLECULAR GLASSES, INC. (US) | 2018-01-02 | — | — | US | disclosed |