Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 3/20 | 0.47 |
| ▸ | CASP1 | P29466 | 5/20 | 0.44 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 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 | |
|---|---|---|---|---|
| SCHEMBL9488115 | 0.81 | CASP1 (0.62) | CASP1TGM2HDAC3HDAC4HDAC1 | |
| SCHEMBL27399235 | 0.77 | NQO2 (0.49) | MEN1KMT2A | |
| SCHEMBL1821309 | 0.76 | HIF1A (0.50) | ERN1CASP1CYP3A4HPGDALDH1A1 | |
| SCHEMBL28233273 | 0.75 | SMN1; SMN2 (0.57) | HPGDSMN1; SMN2L3MBTL1 | |
| SCHEMBL20146220 | 0.74 | CASP1 (0.38) | CASP1CYP3A4ALDH1A1MAPTKMT2A | |
| SCHEMBL17108610 | 0.74 | CASP1 (0.38) | CASP1CYP3A4ALDH1A1MAPTKMT2A | |
| SCHEMBL17108608 | 0.74 | CASP1 (0.38) | CASP1CYP3A4ALDH1A1MAPTKMT2A | |
| SCHEMBL3676772 | 0.73 | TGM2 (0.46) | ERN1TGM2 | |
| SCHEMBL7113446 | 0.73 | CYP3A4 (0.49) | CYP3A4HPGDSMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL15830408 | 0.72 | MEN1 (0.56) | HPGDALDH1A1MEN1MAPTALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3119752-B1 | 3,4-DIAMINO-6-CHLOROPYRAZINE-2-CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF ENAC MEDIATED DISEASES | ASTRAZENECA AB (SE) | 2018-05-16 | — | — | EP | disclosed |