Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 3/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2737124 | 0.84 | LMNA (0.43) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL4122925 | 0.82 | KMT2A (0.43) | KMT2ALMNASMN1; SMN2TSHRAR | |
| SCHEMBL10886037 | 0.80 | KMT2A (0.42) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL7928193 | 0.78 | KMT2A (0.41) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL10639515 | 0.77 | KMT2A (0.40) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL10979488 | 0.77 | KMT2A (0.40) | KMT2ALMNASMN1; SMN2SLC6A2SLC6A4 | |
| SCHEMBL10638172 | 0.77 | KMT2A (0.40) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL21497369 | 0.76 | TSHR (0.42) | KMT2ASMN1; SMN2TSHRARTDP1 | |
| SCHEMBL19867161 | 0.75 | L3MBTL1 (0.40) | KMT2ALMNASMN1; SMN2L3MBTL1SLC6A2 | |
| SCHEMBL3409614 | 0.75 | GRIN2B (0.40) | KMT2ALMNASMN1; SMN2L3MBTL1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3733663-B1 | 1-[6-[[4-(PHENYLAMINO)-6-QUINAZOLINYL]OXY]-3-AZABICYCLO[3.1.1]HEPT-3-YL]-2-PROPEN-1-ONE DERIVATIVES AND RELATED COMPOUNDS AS IRREVERSIBLE INHIBITORS OF PAN-HER TYROSINE KINASE FOR THE TREATMENT OF CANCER | CHENGDU JINRUI FOUND BIOTECH CO LTD (CN) | 2023-05-17 | — | — | EP | disclosed |