Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 10/20 | 0.68 |
| ▸ | PRKCG | P05129 | 2/20 | 0.68 |
| ▸ | AKT1 | P31749 | 2/20 | 0.68 |
| ▸ | SGK1 | O00141 | 1/20 | 0.68 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.68 |
| ▸ | AKT2 | P31751 | 1/20 | 0.68 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.68 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.68 |
| ▸ | CDK1 | P06493 | 1/20 | 0.63 |
| ▸ | CDK2 | P24941 | 1/20 | 0.63 |
| ▸ | KDR | P35968 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.50 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | PRKACA | P17612 | 1/20 | 0.49 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL7701855 | 0.84 | NAMPT (0.64) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7092553 | 0.83 | CDK1 (0.71) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7002081 | 0.82 | CDK1 (0.67) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7000847 | 0.82 | CHEK1 (0.60) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL6998707 | 0.82 | KDR (0.57) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL6794625 | 0.81 | CHEK1 (1.00) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7095511 | 0.81 | CHEK1 (0.59) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7164708 | 0.81 | CHEK1 (0.59) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL7003449 | 0.80 | CHEK1 (0.60) | CHEK1PRKCGAKT1SGK1CHEK2 | |
| SCHEMBL6991537 | 0.80 | CHEK1 (0.57) | CHEK1PRKCGAKT1SGK1CHEK2 |
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-1268437-A1 | INHIBITORS OF PROTEIN KINASES | Knoll GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |
| WO-2002030908-A1 | INHIBITORS OF PROTEIN KINASES | KNOLL GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |
| US-6297238-B1 | 3-ARYL PYRAZOLES WITH 4,5(3,4)-BICYCLIC RING FUSION WHICH ARE INHIBITORS OF PROTEIN KINASES PARTICULARLY TYROSINE KINASES AND SERINE/THREONINE KINASES | BASF AKTIENGESELLSCHAFT (DE) | 2001-10-02 | — | — | US | disclosed |