Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | TSPO | P30536 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9737796 | 0.91 | GABRA2 (0.47) | — | |
| SCHEMBL9738747 | 0.88 | ALDH1A1 (0.45) | TSPO | |
| SCHEMBL9737699 | 0.84 | PTGDR2 (0.46) | — | |
| SCHEMBL9737130 | 0.84 | L3MBTL1 (0.48) | LMNA | |
| SCHEMBL9738542 | 0.83 | TSPO (0.44) | HTR1BHTR2BTSPOLMNA | |
| SCHEMBL9737862 | 0.82 | TSPO (0.52) | TSPOLMNA | |
| SCHEMBL9738233 | 0.82 | KCNQ3 (0.43) | — | |
| SCHEMBL9737572 | 0.81 | TSPO (0.45) | HTR1BHTR2BTSPOLMNA | |
| SCHEMBL9737626 | 0.81 | KCNQ3 (0.45) | — | |
| SCHEMBL9737283 | 0.80 | PTGDR2 (0.47) | LMNA |
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-9458161-B1 | TSPO ligands for cancer imaging and treatment | VANDERBLIT UNIVERSITY (US) | 2016-10-04 | — | — | US | disclosed |
| US-9458161-B1 | TSPO ligands for cancer imaging and treatment | VANDERBLIT UNIVERSITY (US) | 2016-10-04 | — | — | US | disclosed |