Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 10/20 | 0.64 |
| ▸ | CDK2 | P24941 | 2/20 | 0.60 |
| ▸ | CDK1 | P06493 | 1/20 | 0.60 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.58 |
| ▸ | SGK1 | O00141 | 1/20 | 0.58 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.58 |
| ▸ | PRKCG | P05129 | 1/20 | 0.58 |
| ▸ | AKT1 | P31749 | 1/20 | 0.58 |
| ▸ | AKT2 | P31751 | 1/20 | 0.58 |
| ▸ | MARK2 | Q7KZI7 | 1/20 | 0.58 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.58 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 2/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.49 |
| ▸ | CDK4 | P11802 | 1/20 | 0.49 |
| ▸ | CCND1 | P24385 | 1/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 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 | |
|---|---|---|---|---|
| SCHEMBL7698769 | 0.93 | KDR (0.58) | NAMPTCDK2CDK1CHEK1SGK1 | |
| SCHEMBL7701559 | 0.90 | NAMPT (0.52) | NAMPTCDK2CDK1CHEK1KDR | |
| SCHEMBL7705692 | 0.86 | CHEK1 (0.62) | CDK2CDK1CHEK1KDRHTT | |
| SCHEMBL7089915 | 0.84 | CHEK1 (0.68) | CDK2CDK1CHEK1SGK1CHEK2 | |
| SCHEMBL7701963 | 0.84 | CHEK1 (0.57) | CDK2CDK1CHEK1KDR | |
| SCHEMBL7701135 | 0.83 | KMT2A (0.53) | CHEK1NPC1 | |
| SCHEMBL7702362 | 0.83 | KDR (0.52) | NAMPTCDK2CDK1CHEK1KDR | |
| SCHEMBL7092553 | 0.81 | CDK1 (0.71) | CDK2CDK1CHEK1SGK1CHEK2 | |
| SCHEMBL7002081 | 0.81 | CDK1 (0.67) | CDK2CDK1CHEK1SGK1CHEK2 | |
| SCHEMBL7701122 | 0.81 | CHEK1 (0.48) | NAMPTCDK2CDK1CHEK1SGK1 |
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-6462036-B1 | INHIBITING SIGNAL TRANSDUCTION BY MODULATING ACTIVITY OF RECEPTOR AND NONRECEPTOR TYROSINE AND SERINE/THREONINE KINASES TO REGULATE AND MODULATE ABNORMAL OR INAPPROPRIATE CELL PROLIFERATION, DIFFERENTIATION, OR METABOLISM | BASF AKTIENGESELLSCHAFT (DE) | 2002-10-08 | — | — | US | disclosed |