Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 3/20 | 0.44 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | CCND1 | P24385 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 1/20 | 0.41 |
| ▸ | CCNH | P51946 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL789847 | 0.85 | JAK2 (0.46) | ADORA2ACDK1SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL790716 | 0.83 | MAPT (0.43) | ADORA2AMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL790759 | 0.81 | KDM4E (0.47) | ADORA2ASMN1; SMN2KDM4EALDH1A1HTT | |
| SCHEMBL10277681 | 0.80 | LRRK2 (0.47) | MAPTSMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL10277093 | 0.78 | KDM4E (0.43) | ADORA2ACCNA2CDK2CDK1CDK4 | |
| SCHEMBL940196 | 0.75 | ADORA2A (0.50) | ADORA2AMAPTSMN1; SMN2NPC1RAB9A | |
| SCHEMBL940655 | 0.75 | ADORA2A (0.47) | ADORA2ACDK2CDK1MAPTSMN1; SMN2 | |
| SCHEMBL9954672 | 0.69 | TDO2 (0.52) | MAPTSMN1; SMN2NPC1RAB9ATP53 | |
| SCHEMBL790084 | 0.69 | JAK2 (0.48) | SMN1; SMN2KDM4EALDH1A1HPGD | |
| SCHEMBL941557 | 0.68 | PIK3CB (0.50) | ADORA2AMAPTSMN1; SMN2KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |
| WO-2012037108-A1 | AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |