Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12150670 | 0.94 | CYP1A2 (0.34) | SMN1; SMN2NPC1HPGDRAB9ATP53 | |
| SCHEMBL12150671 | 0.82 | HDAC6 (0.35) | HTTKMT2AMEN1 | |
| SCHEMBL185649 | 0.81 | MEN1 (0.36) | ALDH1A1HTTL3MBTL1KMT2AMEN1 | |
| SCHEMBL12150682 | 0.78 | ALDH1A1 (0.38) | ALDH1A1HTTL3MBTL1KMT2AMEN1 | |
| SCHEMBL20386672 | 0.74 | CA1 (0.50) | SMN1; SMN2NPC1HPGDRAB9ATP53 | |
| SCHEMBL29449742 | 0.74 | CA1 (0.50) | SMN1; SMN2NPC1HPGDRAB9ATP53 | |
| SCHEMBL4669496 | 0.74 | CA1 (0.50) | SMN1; SMN2NPC1HPGDRAB9ATP53 | |
| SCHEMBL2735501 | 0.74 | KCNA5 (0.35) | ALDH1A1HTTKMT2AMEN1 | |
| SCHEMBL12150761 | 0.74 | KCNA5 (0.35) | ALDH1A1HTTKMT2AMEN1 | |
| SCHEMBL19275049 | 0.73 | CA1 (0.48) | TP53ESR1ALDH1A1HTTL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8722208-B2 | Organic electroluminescent device | NIPPON STEEL & SUMIKIN CHEMICAL CO., LTD. (JP) | 2014-05-13 | — | — | US | disclosed |
| US-20110284828-A1 | ORGANIC ELECTROLUMINESCENT DEVICE | NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) | 2011-11-24 | — | — | US | disclosed |