Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
| ▸ | AKT2 | P31751 | 1/20 | 0.47 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.47 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 4/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30783721 | 1.00 | AKT1 (0.47) | AKT1AKT2AKT3CRHR1TSHR | |
| SCHEMBL30784055 | 0.90 | AKT1 (0.48) | AKT1AKT2AKT3CRHR1TSHR | |
| SCHEMBL30783611 | 0.88 | AKT1 (0.45) | AKT1AKT2AKT3CRHR1KDM1A | |
| SCHEMBL30783583 | 0.86 | AKT1 (0.47) | AKT1AKT2AKT3CRHR1KMT2A | |
| SCHEMBL30784348 | 0.86 | AKT1 (0.47) | AKT1AKT2AKT3CRHR1KMT2A | |
| SCHEMBL25360674 | 0.85 | AKT1 (0.52) | AKT1AKT2AKT3CRHR1PTPN11 | |
| SCHEMBL31538199 | 0.85 | AKT1 (0.61) | AKT1AKT2AKT3CRHR1PTPN11 | |
| SCHEMBL30690362 | 0.85 | AKT1 (0.61) | AKT1AKT2AKT3CRHR1PTPN11 | |
| SCHEMBL25360677 | 0.85 | AKT1 (0.52) | AKT1AKT2AKT3CRHR1PTPN11 | |
| SCHEMBL30495297 | 0.85 | AKT1 (0.52) | AKT1AKT2AKT3CRHR1PTPN11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024000401-A1 | 2-((1-(6-METHYL-4-OXO-3,4-DIHYDROQUINAZOLIN-8-YL)ETHYL)AMINO)BENZOIC ACID DERIVATIVES AND SIMILAR COMPOUNDS AS PI3K INHIBITORS FOR THE TREATMENT OF E.G. CANCER | QILU REGOR THERAPEUTICS INC. (CN) | 2024-01-04 | — | — | WO | disclosed |