Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.44 |
| ▸ | BTK | Q06187 | 5/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 5/20 | 0.41 |
| ▸ | CDK1 | P06493 | 4/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 2/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23021006 | 0.85 | L3MBTL1 (0.48) | GRM5BTKCDK5CCNA2CDK2 | |
| Hydrochloric Acid SCHEMBL22999706 | 0.84 | L3MBTL1 (0.47) | GRM5BTKCDK5CCNA2CDK2 | |
| SCHEMBL23021018 | 0.82 | CDK2 (0.43) | GRM5BTKCDK5CCNA2CDK2 | |
| Hydrochloric Acid SCHEMBL22999658 | 0.81 | CDK2 (0.42) | GRM5BTKCDK5CCNA2CDK2 | |
| SCHEMBL23000014 | 0.80 | GRM5 (0.54) | GRM5CDK5CCNA2CDK2CDK5R1 | |
| SCHEMBL23021015 | 0.80 | BRD4 (0.44) | CDK5CCNA2CDK2CDK5R1KDR | |
| SCHEMBL23021023 | 0.80 | CDK2 (0.43) | GRM5BTKCDK5CCNA2CDK2 | |
| SCHEMBL23020730 | 0.79 | ULK1 (0.45) | BTKCDK5CCNA2CDK2CDK5R1 | |
| SCHEMBL23021156 | 0.79 | CDK2 (0.63) | GRM5CDK5CCNA2CDK2CDK5R1 | |
| Hydrochloric Acid SCHEMBL22999614 | 0.77 | CDK2 (0.62) | GRM5CDK5CCNA2CDK2CDK5R1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021032323-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | GALAPAGOS NV (BE) | 2021-02-25 | — | — | WO | disclosed |
| EP-3782997-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | Galapagos N.V. (BE) | 2021-02-24 | — | — | EP | disclosed |
| EP-3782997-A1 | FUSED PYRIMIDINE COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROTIC DISEASES | Galapagos N.V. (BE) | 2021-02-24 | — | — | EP | disclosed |