Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 4/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.48 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | BMX | P51813 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL26551585 | 0.81 | BMX (0.43) | CYP11B2CYP11B1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL13979742 | 0.80 | CYP11B1 (0.49) | CYP11B2CYP11B1KDM4EALDH1A1HPGD | |
| SCHEMBL19933734 | 0.80 | CYP11B1 (0.41) | CYP11B2CYP11B1KDM4EALDH1A1HPGD | |
| SCHEMBL26554492 | 0.80 | BMX (0.42) | CYP11B2CYP11B1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL1534980 | 0.79 | CYP11B2 (0.48) | CYP11B2CYP11B1KDM4EALDH1A1HPGD | |
| SCHEMBL13134510 | 0.79 | CYP11B1 (0.52) | CYP11B2CYP11B1KDM4EALDH1A1HPGD | |
| SCHEMBL25768309 | 0.79 | NOS1 (0.43) | CYP11B2CYP11B1KDM4EALDH1A1HPGD | |
| SCHEMBL14988289 | 0.79 | CYP11B1 (0.48) | CYP11B2CYP11B1TGFBR1KDM4EALDH1A1 | |
| SCHEMBL16502663 | 0.77 | DHODH (0.46) | KDM4EALDH1A1HPGDKMT2ADHODH | |
| SCHEMBL19794377 | 0.76 | CYP11B1 (0.46) | CYP11B2CYP11B1KDM4EALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-112912372-A | Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element | 东曹株式会社 | 2021-06-04 | — | — | CN | disclosed |
| WO-2020085319-A1 | CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT | 東ソー株式会社 | 2020-04-30 | — | — | WO | disclosed |