Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 4/20 | 0.43 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | PDE2A | O00408 | 5/20 | 0.42 |
| ▸ | THRA | P10827 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16852405 | 0.99 | PDK2 (0.42) | PDK2PTPN11NR5A1TSHRPDE2A | |
| SCHEMBL16852412 | 0.96 | MEN1 (0.41) | PDK2PDE2A | |
| SCHEMBL16852416 | 0.90 | ACACB (0.41) | PDK2PDE2A | |
| SCHEMBL11036498 | 0.88 | NR5A1 (0.53) | PDK2PTPN11NR5A1TSHRTHRA | |
| SCHEMBL1313964 | 0.86 | PDK2 (0.43) | PDK2PTPN11NR5A1TSHRPDE2A | |
| SCHEMBL17565151 | 0.85 | NR5A1 (0.53) | NR5A1TSHRTHRATHRBTP53 | |
| SCHEMBL16852406 | 0.84 | HMOX1 (0.43) | PDK2 | |
| SCHEMBL16852404 | 0.83 | CNR2 (0.46) | PDK2PTPN11NR5A1 | |
| SCHEMBL10302505 | 0.82 | PTPN11 (0.42) | PTPN11NR5A1 | |
| SCHEMBL10302508 | 0.82 | PTPN11 (0.42) | PTPN11NR5A1 |
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-9951274-B2 | Liquid-crystalline medium | MERCK PATENT GMBH (DE) | 2018-04-24 | — | — | US | disclosed |
| US-20150175884-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-06-25 | — | — | US | disclosed |