Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 1.00 |
| ▸ | CDK2 | P24941 | 1/20 | 1.00 |
| ▸ | KDR | P35968 | 8/20 | 0.80 |
| ▸ | CHEK1 | O14757 | 8/20 | 0.70 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.51 |
| ▸ | SGK1 | O00141 | 1/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.45 |
| ▸ | PRKCG | P05129 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | AKT2 | P31751 | 1/20 | 0.45 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.45 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969778 | 1.00 | CDK1 (1.00) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL29819445 | 0.89 | KDR (1.00) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL6968182 | 0.89 | KDR (1.00) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL30583253 | 0.88 | CDK1 (0.78) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL4996872 | 0.88 | CDK1 (0.78) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL7089728 | 0.87 | NPC1 (0.81) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL6969359 | 0.84 | KDR (0.74) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL7092553 | 0.84 | CDK1 (0.71) | CDK1CDK2KDRCHEK1NPC1 | |
| SCHEMBL7000053 | 0.84 | CHEK1 (0.97) | CDK1CDK2KDRCHEK1 | |
| SCHEMBL6967709 | 0.84 | KDR (0.78) | CDK1CDK2KDRCHEK1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4256086-A1 | METHODS AND SYSTEMS OF STRATIFYING INFLAMMATORY DISEASE PATIENTS | Cedars-Sinai Medical Center (US) | 2023-10-11 | — | — | EP | disclosed |
| EP-4162076-A1 | TREATMENTS FOR A SUB-POPULATION OF INFLAMMATORY BOWEL DISEASE PATIENTS | Cedars-Sinai Medical Center (US) | 2023-04-12 | — | — | EP | disclosed |
| WO-2022119842-A1 | METHODS AND SYSTEMS OF STRATIFYING INFLAMMATORY DISEASE PATIENTS | CEDARS-SINAI MEDICAL CENTER (US) | 2022-06-09 | — | — | WO | disclosed |