Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.40 |
| ▸ | GPR3 | P46089 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL28575112 | 0.84 | GPR3 (0.42) | NPC1RAB9AGPR3ALDH1A1CYP1A2 | |
| SCHEMBL21879689 | 0.84 | GPR3 (0.48) | RAB9AGPR3ALDH1A1CYP1A2KDM4E | |
| SCHEMBL22780062 | 0.78 | CYP11B1 (0.51) | NPC1RAB9ACYP11B1GPR3DYRK1A | |
| SCHEMBL21295743 | 0.75 | DYRK1A (0.42) | NPC1RAB9ACYP11B1DYRK1ADYRK1B | |
| SCHEMBL28570307 | 0.74 | GABRA1 (0.44) | NPC1RAB9AGPR3ALDH1A1CYP1A2 | |
| SCHEMBL21295683 | 0.73 | NPC1 (0.42) | NPC1RAB9ACYP11B1GPR3DYRK1A | |
| SCHEMBL21295951 | 0.72 | GPR3 (0.42) | NPC1RAB9AGPR3CYP3A4ALDH1A1 | |
| SCHEMBL21296035 | 0.71 | CYP2A6 (0.45) | NPC1RAB9ACYP11B1DYRK1ADYRK1B | |
| SCHEMBL21879710 | 0.70 | CYP11B1 (0.44) | NPC1RAB9ACYP11B1DYRK1ADYRK1B | |
| SCHEMBL19166781 | 0.70 | CYP11B1 (0.47) | NPC1RAB9ACYP11B1CYP2A6CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109311844-B | Triazine compound, method for producing same, and organic electroluminescent element containing same as constituent component | 东曹株式会社 | 2021-07-20 | — | — | CN | disclosed |
| 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 |