Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18784033 | 0.93 | TSHR (0.62) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL16433698 | 0.91 | TSHR (0.60) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL40586 | 0.90 | TSHR (0.45) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL27870592 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| Methane SCHEMBL28850574 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL16134389 | 0.89 | TSHR (0.43) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| Benzene SCHEMBL28184515 | 0.85 | TSHR (0.41) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| Propane SCHEMBL8922359 | 0.85 | ALDH1A1 (0.47) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL8931133 | 0.84 | TSHR (0.39) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 | |
| SCHEMBL28011877 | 0.83 | TSHR (0.42) | TSHRSMN1; SMN2ALDH1A1TDP1USP2 |
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-2009156455-A1 | METHOD FOR PRODUCING A NANOPARTICLE, NANOPARTICLE, NANOPARTICLE SYSTEM AND ITS USE | FREIE UNIVERSITÄT BERLIN (DE) | 2009-12-30 | — | — | WO | disclosed |