Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | PLG | P00747 | 1/20 | 0.44 |
| ▸ | PLAT | P00750 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9746896 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL9578606 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL27480731 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL27748051 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL9578611 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL9578607 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL27748100 | 1.00 | TP53 (0.54) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL4159836 | 0.98 | PKM (0.51) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL1961977 | 0.98 | PKM (0.51) | TP53HTTMEN1KMT2APKM | |
| SCHEMBL4159828 | 0.98 | PKM (0.51) | TP53HTTMEN1KMT2APKM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101280195-B | 3,4-Difluorothiophenol ether liquid crystal compounds | XIAN MODERN CHEMISTRY RES INST | 2011-01-26 | — | — | CN | disclosed |
| CN-101280195-A | 3,4-Difluorothiophenol ether liquid crystal compounds | XIAN MODERN CHEMISTRY RES INST (CN) | 2008-10-08 | — | — | CN | disclosed |
| CN-1037334-A | Pyridine derivate | MERCK PATENT GMBH (DE) | 1989-11-22 | — | — | CN | disclosed |