Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL22375160 | 0.79 | GAA (0.46) | GAAHTTADORA3ADORA1ADORA2A | |
| SCHEMBL5030585 | 0.76 | MAPT (0.37) | GAAMAPTCYP3A4ALDH1A1 | |
| SCHEMBL9760917 | 0.74 | GAA (0.45) | GAAHTTADORA3ADORA1ADORA2A | |
| SCHEMBL9761852 | 0.67 | L3MBTL1 (0.41) | GAAHTTPOLBSMN1; SMN2MAPT | |
| SCHEMBL9762636 | 0.66 | RIPK1 (0.41) | GAAHTTPOLBADORA1SMN1; SMN2 | |
| SCHEMBL7395073 | 0.62 | MAPK1 (0.44) | GAAHTTADORA3ADORA1ADORA2A | |
| SCHEMBL7701711 | 0.61 | ALDH1A1 (0.35) | POLBMAPTLMNAKMT2AKDM4E | |
| SCHEMBL20553556 | 0.61 | ALDH1A1 (0.35) | POLBMAPTLMNAKMT2AKDM4E | |
| SCHEMBL3965790 | 0.60 | GAA (0.42) | GAAHTTPOLBSMN1; SMN2MAPT | |
| SCHEMBL8813561 | 0.60 | GAA (0.42) | GAAHTTPOLBSMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-5026694-A | Antitumor agents | THE BRITISH COLUMBIA CANCER FOUNDATION (CA) | 1991-06-25 | — | — | US | disclosed |