Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
| ▸ | GCK | P35557 | 1/20 | 0.37 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.33 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2493333 | 0.85 | KDR (0.43) | PDE10AKDRCYP1A1CYP1A2CYP1B1 | |
| SCHEMBL2493080 | 0.78 | KCNN1 (0.42) | KDRGCKCDK5CDK5R1NPC1 | |
| SCHEMBL190433 | 0.71 | RAB9A (0.55) | GCKCYP1A1CYP1A2CYP1B1SMN1; SMN2 | |
| SCHEMBL6281996 | 0.65 | MAPT (0.62) | CYP1A1CYP1B1SMN1; SMN2NPC1POLB | |
| SCHEMBL190426 | 0.65 | KCNN1 (0.61) | CYP1A1CYP1A2CYP1B1SMN1; SMN2NPC1 | |
| SCHEMBL190602 | 0.65 | NPC1 (0.58) | GCKCYP1A1CYP1A2CYP1B1SMN1; SMN2 | |
| SCHEMBL191394 | 0.64 | RAB9A (0.58) | CYP1A1CYP1A2CYP1B1SMN1; SMN2NPC1 | |
| SCHEMBL12305708 | 0.63 | GCK (0.47) | PDE10AKDRGCKSMN1; SMN2NPC1 | |
| SCHEMBL190888 | 0.63 | GCK (0.51) | GCKPOLBMAPT | |
| SCHEMBL191840 | 0.63 | RAB9A (0.47) | GCKSMN1; SMN2NPC1POLBMAPT |
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 |