Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 4/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | GRM4 | Q14833 | 2/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | MECP2 | P51608 | 1/20 | 0.35 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.35 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.35 |
| ▸ | MBD2 | Q9UBB5 | 1/20 | 0.35 |
| ▸ | KCNN3 | Q9UGI6 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.33 |
| ▸ | GCK | P35557 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL190948 | 0.77 | KCNN1 (0.49) | MECP2KCNN1KCNN2MBD2KCNN3 | |
| SCHEMBL191010 | 0.71 | NPC1 (0.48) | GRM4KCNH2 | |
| SCHEMBL190731 | 0.70 | GCK (0.45) | BRAFGCK | |
| SCHEMBL2493080 | 0.69 | KCNN1 (0.42) | TGFBR1KDRGRM4MECP2KCNN1 | |
| SCHEMBL6372588 | 0.68 | MECP2 (0.55) | KDRGRM4MECP2KCNN1KCNN2 | |
| SCHEMBL191400 | 0.67 | GCK (0.44) | BRAFGCK | |
| Bromide SCHEMBL5174776 | 0.67 | MECP2 (0.54) | KDRGRM4MECP2KCNN1KCNN2 | |
| SCHEMBL5171103 | 0.65 | MECP2 (0.51) | KDRGRM4MECP2KCNN1KCNN2 | |
| SCHEMBL191875 | 0.64 | NPC1 (0.43) | TGFBR1PDE10AKDRBRAF | |
| SCHEMBL191705 | 0.63 | GCK (0.37) | BRAFGCK |
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-8022222-B2 | Glucokinase activators | ARRAY BIOPHARMA, INC. (US) | 2011-09-20 | — | — | US | disclosed |