Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.43 |
| ▸ | ACR | P10323 | 2/20 | 0.43 |
| ▸ | RARB | P10826 | 2/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 3/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.41 |
| ▸ | THRA | P10827 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
| ▸ | MDH1 | P40925 | 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL9841540 | 0.96 | MAPT (0.47) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841899 | 0.95 | PRSS1 (0.48) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841904 | 0.95 | PRSS1 (0.48) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841923 | 0.95 | PRSS1 (0.48) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841586 | 0.93 | MAPT (0.45) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841811 | 0.89 | RXRA (0.41) | MAPTKMT2APRSS1PLK1NPC1 | |
| Fluoride SCHEMBL9841273 | 0.88 | MAPT (0.57) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841343 | 0.85 | MAPT (0.44) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| SCHEMBL15693578 | 0.85 | MAPT (0.48) | MAPTKMT2ASMN1; SMN2PRSS1ACR | |
| Fluoride SCHEMBL9841387 | 0.84 | MAPT (0.51) | MAPTKMT2ASMN1; SMN2PRSS1ACR |
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-5055223-A | For use in liquid crystal display elements | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-10-08 | — | — | US | disclosed |