Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 4/20 | 0.54 |
| ▸ | IDO1 | P14902 | 1/20 | 0.52 |
| ▸ | PDE5A | O76074 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | TLR4 | O00206 | 1/20 | 0.43 |
| ▸ | TLR3 | O15455 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28866549 | 0.84 | MAOB (0.49) | MAPTMAPK1TDP1L3MBTL1TLR9 | |
| SCHEMBL6028879 | 0.83 | PTGER1 (0.53) | PTGER1 | |
| SCHEMBL6452344 | 0.81 | TLR9 (0.51) | MAPTMAPK1HTR1ADRD2TLR9 | |
| SCHEMBL6448897 | 0.81 | MAOB (0.48) | BRD4HTR1ADRD2TLR9TLR7 | |
| SCHEMBL11625444 | 0.80 | ALDH1A1 (0.50) | PDE5AMAPTTDP1L3MBTL1 | |
| SCHEMBL3103763 | 0.80 | L3MBTL1 (0.44) | BRD4IDO1L3MBTL1PTGER1 | |
| SCHEMBL15825571 | 0.79 | POLB (0.51) | TDP1L3MBTL1 | |
| SCHEMBL26013299 | 0.78 | MAPT (0.63) | BRD4IDO1MAPTMAPK1TDP1 | |
| SCHEMBL14863659 | 0.77 | LMNA (0.37) | IDO1PDE5APDE4APDE4BPDE4C | |
| SCHEMBL28284772 | 0.77 | ADRA1D (0.58) | BRD4IDO1PDE5APDE4APDE4B |
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-103476252-B | Pyrazolyl guanidine F1F 0-ATPase inhibitors and therapeutic uses thereof | 莱斯拉公司 | 2017-02-22 | — | — | CN | disclosed |