Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2127807 | 0.94 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL30730878 | 0.93 | KDM4E (0.49) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL1321259 | 0.93 | KDM4E (0.49) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL26263189 | 0.91 | TNF (0.52) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL3414833 | 0.91 | MAPT (0.47) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL29407412 | 0.91 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL702934 | 0.91 | ALDH1A1 (0.50) | ALDH1A1KDM4EHPGDTSHRHSD17B10 | |
| SCHEMBL2967358 | 0.90 | KDM4E (0.44) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL6252047 | 0.90 | CA12 (0.46) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| Biphenyl SCHEMBL28230506 | 0.90 | CES1 (0.49) | ALDH1A1KDM4EMAPTHPGDTSHR |
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-101597255-B | Organic material and application thereof in organic electroluminescence device (OELD) | UNIV TSINGHUA | 2012-10-24 | — | — | CN | disclosed |
| CN-101597255-A | A kind of organic materials and the application in organic electroluminescence device thereof | UNIV TSINGHUA (CN) | 2009-12-09 | — | — | CN | disclosed |