Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.69 |
| ▸ | MAPT | P10636 | 4/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.53 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.50 |
| ▸ | RELA | Q04206 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13108718 | 0.92 | KMT2A (0.59) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL32668864 | 0.90 | ALDH1A1 (0.81) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL29556760 | 0.90 | ALDH1A1 (0.81) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL2849974 | 0.90 | ALDH1A1 (0.81) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL13108734 | 0.88 | ALDH1A1 (0.79) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL3445210 | 0.88 | SMN1; SMN2 (0.81) | ALDH1A1MAPTSMN1; SMN2NPSR1KMT2A | |
| SCHEMBL830034 | 0.84 | SMN1; SMN2 (0.69) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL28327930 | 0.82 | SMN1; SMN2 (0.57) | ALDH1A1MAPTSMN1; SMN2NPSR1POLB | |
| SCHEMBL5475289 | 0.82 | ALDH1A1 (0.67) | ALDH1A1MAPTSMN1; SMN2L3MBTL1KMT2A | |
| SCHEMBL5476339 | 0.82 | ALDH1A1 (0.67) | ALDH1A1MAPTSMN1; SMN2L3MBTL1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108269949-B | The organic electroluminescence device of bipolar host material containing 1,2,4- triazine group | 广东阿格蕾雅光电材料有限公司 | 2019-09-10 | — | — | CN | disclosed |
| CN-108264505-B | A kind of bipolar host material containing 1,2,4- triazine group and application | 广东阿格蕾雅光电材料有限公司 | 2019-09-10 | — | — | CN | disclosed |
| CN-108269949-A | The organic electroluminescence device of bipolar host material containing 1,2,4- triazine groups | 广东阿格蕾雅光电材料有限公司 | 2018-07-10 | — | — | CN | disclosed |
| CN-108264505-A | A kind of bipolar host material containing 1,2,4- triazine groups and application | 广东阿格蕾雅光电材料有限公司 | 2018-07-10 | — | — | CN | disclosed |