Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 5/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 5/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.33 |
| ▸ | HTR5A | P47898 | 6/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16502728 | 0.85 | NPC1 (0.43) | GABRA5HTR5AKDM4ENPC1ALDH1A1 | |
| SCHEMBL7914783 | 0.85 | GABRG2 (0.34) | GABRG2GABRB3GABRA5GABRA3HTR5A | |
| SCHEMBL16503575 | 0.85 | GABRG2 (0.35) | GABRG2GABRB3GABRA5GABRA3HTR5A | |
| SCHEMBL16502739 | 0.80 | PLA2G2D (0.45) | GABRG2GABRB3GABRA5GABRA3HTR5A | |
| SCHEMBL7919762 | 0.77 | KDM4E (0.34) | KDM4ENPC1ALDH1A1MAPTHPGD | |
| SCHEMBL16502705 | 0.74 | S1PR1 (0.42) | KDM4ENPC1ALDH1A1TP53GLA | |
| SCHEMBL16502840 | 0.74 | HTR5A (0.58) | HTR5A | |
| SCHEMBL16502737 | 0.74 | TP53 (0.42) | HTR5AKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL7915988 | 0.74 | HTR5A (0.39) | HTR5AKDM4ENPC1ALDH1A1TP53 | |
| SCHEMBL16503545 | 0.74 | LMNA (0.40) | KDM4ENPC1ALDH1A1TP53MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2394987-A1 | ACYLGUANIDINE DERIVATIVE | Astellas Pharma Inc. (JP) | 2011-12-14 | — | — | EP | disclosed |