Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | USP2 | O75604 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.43 |
| ▸ | EDNRA | P25101 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3636997 | 0.87 | ALDH1A1 (0.51) | HSD17B10ALDH1A1USP2HPGDMEN1 | |
| SCHEMBL3635425 | 0.82 | HPGD (0.42) | HSD17B10ALDH1A1USP2HPGDMEN1 | |
| SCHEMBL3634795 | 0.81 | MAPK8 (0.42) | ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL3630797 | 0.81 | EDNRB (0.41) | HSD17B10ALDH1A1USP2HPGDMEN1 | |
| SCHEMBL3636994 | 0.80 | MAPK8 (0.47) | — | |
| SCHEMBL9281684 | 0.78 | HTT (0.59) | HSD17B10ALDH1A1USP2HPGDMEN1 | |
| Hydrochloric Acid SCHEMBL2488114 | 0.73 | KCNH2 (0.42) | — | |
| SCHEMBL847034 | 0.72 | SMN1; SMN2 (0.52) | HSD17B10ALDH1A1USP2HPGDMEN1 | |
| SCHEMBL22162673 | 0.72 | GPR17 (0.53) | MGLL | |
| SCHEMBL848642 | 0.70 | MAPK8 (0.59) | MEN1KMT2AKDM4EEDNRATSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009015917-A2 | DIHYDROQUINONE AND DIHYDRONAPHTHRIDINE INHIBITORS OF JNK | F. HOFFMANN-LA ROCHE AG (CH) | 2009-02-05 | — | — | WO | disclosed |