Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 5/20 | 0.53 |
| ▸ | RXRA | P19793 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NPY1R | P25929 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NPY2R | P49146 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9000392 | 1.00 | CHAT (0.53) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL10706694 | 0.89 | CHAT (0.62) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL10706687 | 0.89 | CHAT (0.62) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL10706700 | 0.89 | CHAT (0.62) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL10437274 | 0.86 | CHAT (0.60) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL10437275 | 0.86 | CHAT (0.60) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL6323842 | 0.86 | CHAT (0.51) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL9000377 | 0.82 | ALDH1A1 (0.43) | CHATRXRAKDM4EPTGS1PTGS2 | |
| SCHEMBL9168728 | 0.80 | CHAT (0.70) | CHATPTGS1PTGS2HDAC8HDAC6 | |
| SCHEMBL9168725 | 0.80 | CHAT (0.70) | CHATPTGS1PTGS2HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0516409-B1 | Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same | MITSUI TOATSU CHEMICALS (JP) | 1996-09-11 | — | — | EP | disclosed |
| US-5416213-A | Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same | MITSUI TOATSU CHEMICALS, INC. (JP) | 1995-05-16 | — | — | US | disclosed |
| EP-0516409-A2 | Tetravinylpyrazine compound, method for preparing same and electroluminescent element and non-linear optical material using same | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1992-12-02 | — | — | EP | disclosed |