Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | PLK1 | P53350 | 2/20 | 0.48 |
| ▸ | PLA2G4B | P0C869 | 4/20 | 0.48 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.47 |
| ▸ | RARB | P10826 | 3/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.46 |
| ▸ | RELA | Q04206 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | PLA2G4A | P47712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8533431 | 0.82 | NPC1 (0.53) | TP53TSHRPLK1PLA2G4BRARB | |
| SCHEMBL9163986 | 0.80 | PLK1 (0.62) | TP53TSHRPLK1PLA2G4BPTPN11 | |
| SCHEMBL10907007 | 0.79 | PTPN11 (0.59) | TP53TSHRPLK1PLA2G4BPTPN11 | |
| SCHEMBL10593313 | 0.77 | RARB (0.64) | TP53TSHRPLK1PLA2G4BPTPN11 | |
| SCHEMBL3712497 | 0.77 | TP53 (0.60) | TP53TSHRPLA2G4BPTPN11RARB | |
| SCHEMBL13152978 | 0.77 | TP53 (0.60) | TP53TSHRPLA2G4BPTPN11RARB | |
| SCHEMBL8537135 | 0.76 | RARB (0.44) | TSHRPLK1RARBNFKB1NFKB2 | |
| SCHEMBL15255112 | 0.76 | LMNA (0.74) | TP53TSHRPLA2G4BRARBNFKB1 | |
| SCHEMBL9407176 | 0.76 | LMNA (0.74) | TP53TSHRPLA2G4BRARBNFKB1 | |
| SCHEMBL3721961 | 0.75 | PTPN11 (0.50) | TP53TSHRPLK1PLA2G4BPTPN11 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5776365-A | COMPOUNDS WITH OPTICAL ACTIVITY AND SWITCHES FOR CONTRAST | MITSUI CHEMICALS, INC. (JP) | 1998-07-07 | — | — | US | disclosed |
| US-5725798-A | CARBOXYLIC ESTERS FOR ELECTRICAL APPARATUS, SWITCHES AND CONTRAST | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-10 | — | — | US | disclosed |