Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28833648 | 0.81 | GAA (0.42) | KDM4ETSHRGAA | |
| SCHEMBL27842836 | 0.79 | PGR (0.39) | KDM4ETSHRAPPPGRPTGS1 | |
| SCHEMBL27570240 | 0.79 | MAPT (0.48) | MAPTALDH1A1KDM4EL3MBTL1TSHR | |
| SCHEMBL27669886 | 0.76 | PTGS1 (0.42) | MAPTTSHRCYP3A4APPCYP1A2 | |
| SCHEMBL17813143 | 0.76 | MAPT (0.50) | MAPTCRHR1 | |
| SCHEMBL29510759 | 0.74 | CYP1A2 (0.50) | ALDH1A1TSHRSMN1; SMN2ALOX5CYP1A2 | |
| SCHEMBL5937174 | 0.74 | CYP1A2 (0.50) | ALDH1A1TSHRSMN1; SMN2ALOX5CYP1A2 | |
| SCHEMBL30616847 | 0.74 | MAPT (0.49) | MAPTALDH1A1KDM4EL3MBTL1TSHR | |
| SCHEMBL29510782 | 0.74 | CYP1A2 (0.50) | ALDH1A1TSHRSMN1; SMN2ALOX5CYP1A2 | |
| SCHEMBL3159375 | 0.74 | MAPT (0.49) | MAPTALDH1A1KDM4EL3MBTL1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-104011021-B | heterocyclic derivatives and their use as prostaglandin D2 receptor modulators | 埃科特莱茵药品有限公司 | 2016-08-24 | — | — | CN | disclosed |