Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 13/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1836133 | 0.77 | KDM4E (0.61) | NISCHKDM4E | |
| SCHEMBL10473113 | 0.76 | NISCH (0.45) | NISCHKDM4E | |
| SCHEMBL1882130 | 0.74 | NISCH (0.62) | NISCH | |
| SCHEMBL9374955 | 0.73 | NISCH (0.43) | NISCHCYP1A2KDM4E | |
| SCHEMBL29769309 | 0.73 | KDM4E (0.55) | KDM4E | |
| SCHEMBL687180 | 0.73 | KDM4E (0.55) | KDM4E | |
| SCHEMBL9375560 | 0.72 | NISCH (0.61) | NISCHCYP1A2KDM4E | |
| SCHEMBL3399485 | 0.71 | NISCH (0.51) | NISCHKDM4E | |
| SCHEMBL31234064 | 0.69 | NISCH (0.61) | NISCHCYP1A2KDM4E | |
| SCHEMBL2385163 | 0.69 | NISCH (0.61) | NISCHCYP1A2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | claimed |
| WO-2010018458-A2 | PHENOL DERIVATIVES AND METHODS OF USE THEREOF | CRYSTALGENOMICS, INC. (KR) | 2010-02-18 | — | — | WO | disclosed |