Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STIM1 | Q13586 | 1/20 | 0.39 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.39 |
| ▸ | BRAF | P15056 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 1/20 | 0.38 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.37 |
| ▸ | KCNT1 | Q5JUK3 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | WNT1 | P04628 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL22659804 | 1.00 | STIM1 (0.39) | STIM1ORAI1KLKB1NTRK1BRAF | |
| SCHEMBL22659007 | 0.93 | BRAF (0.45) | KLKB1NTRK1BRAFHTR2CMCHR1 | |
| SCHEMBL24571432 | 0.91 | NTRK1 (0.42) | STIM1ORAI1NTRK1BRAFFLT3 | |
| SCHEMBL22659083 | 0.90 | HTR2C (0.44) | STIM1ORAI1NTRK1BRAFHTR2C | |
| SCHEMBL22659187 | 0.89 | KCNT1 (0.40) | STIM1ORAI1NTRK1BRAFFLT3 | |
| SCHEMBL22659218 | 0.88 | BRAF (0.39) | STIM1ORAI1NTRK1BRAFFLT3 | |
| SCHEMBL22658921 | 0.88 | STIM1 (0.41) | STIM1ORAI1NTRK1BRAFHTR2C | |
| SCHEMBL22659819 | 0.87 | MCHR1 (0.41) | STIM1ORAI1NTRK1BRAFHTR2C | |
| SCHEMBL22659073 | 0.86 | BRAF (0.40) | STIM1ORAI1NTRK1BRAFFLT3 | |
| SCHEMBL24571228 | 0.86 | STIM1 (0.42) | STIM1ORAI1NTRK1BRAFFLT3 |
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-3966208-A2 | COMPOUNDS AND METHODS FOR TREATING CANCER | Antidote IP Holdings, LLC (US) | 2022-03-16 | — | — | EP | disclosed |