Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.37 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17192295 | 0.92 | KDM4E (0.41) | ALDH1A1KDM4EMAPTHPGDTSHR | |
| SCHEMBL17192244 | 0.91 | THRB (0.38) | ALDH1A1KDM4EMAPTHPGDMEN1 | |
| SCHEMBL17192241 | 0.89 | THRB (0.40) | ALDH1A1KDM4EMAPTHPGDMEN1 | |
| SCHEMBL17192257 | 0.89 | THRB (0.40) | ALDH1A1KDM4EMAPTHPGDMEN1 | |
| SCHEMBL17192240 | 0.87 | KDM4E (0.42) | ALDH1A1KDM4EMAPTHPGDPOLB | |
| SCHEMBL17192245 | 0.84 | ALDH1A1 (0.51) | ALDH1A1KDM4EMAPTHPGDPOLB | |
| SCHEMBL17192311 | 0.83 | ALDH1A1 (0.41) | ALDH1A1KDM4EMAPTHPGDPOLB | |
| SCHEMBL17192247 | 0.83 | ALDH1A1 (0.44) | ALDH1A1KDM4EMAPTHPGDPOLB | |
| SCHEMBL17192279 | 0.82 | MAPT (0.43) | ALDH1A1KDM4EMAPTHPGDPOLB | |
| SCHEMBL17192259 | 0.81 | MAPT (0.42) | ALDH1A1KDM4EMAPTHPGDPOLB |
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 |
|---|---|---|---|---|---|---|---|
| US-20170362506-A1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2017-12-21 | — | — | US | disclosed |
| US-20160319194-A1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2016-11-03 | — | — | US | disclosed |
| US-20150299574-A1 | LIQUID CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2015-10-22 | — | — | US | disclosed |