Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 3/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9000337 | 0.78 | CYP11B1 (0.44) | KDM1AHDAC1HDAC6ALDH1A1RAB9A | |
| SCHEMBL9000353 | 0.76 | CYP11B2 (0.50) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNB3 | |
| SCHEMBL30963861 | 0.73 | CYP11B1 (0.53) | HDAC6CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL30963859 | 0.73 | CYP11B1 (0.53) | HDAC6CHRNB1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL16805019 | 0.73 | CHRNB1 (0.45) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNB3 | |
| SCHEMBL9000571 | 0.73 | HDAC8 (0.41) | HDAC6CHRNB4CHRNA3TNFKDM4E | |
| SCHEMBL9000391 | 0.72 | CYP11B1 (0.46) | KDM4EALDH1A1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL9000334 | 0.71 | CA12 (0.38) | TNFKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL9000346 | 0.71 | KDM1A (0.47) | KDM1AHDAC1HDAC6KDM4EALDH1A1 | |
| SCHEMBL18253148 | 0.70 | TNF (0.52) | HDAC6TNFKDM4EALDH1A1MAPT |
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 |