Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADH1B | P00325 | 2/20 | 0.38 |
| ▸ | ADH1C | P00326 | 2/20 | 0.38 |
| ▸ | ADH1A | P07327 | 2/20 | 0.38 |
| ▸ | ADH4 | P08319 | 2/20 | 0.38 |
| ▸ | ADH7 | P40394 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25701264 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL20807027 | 0.98 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL21920454 | 0.91 | TSHR (0.58) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL13190585 | 0.91 | TSHR (0.50) | ALDH1A1TSHRCYP3A4LMNAADH1B | |
| SCHEMBL14139579 | 0.89 | TSHR (0.54) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL24347570 | 0.88 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL27383605 | 0.88 | ALDH1A1 (0.54) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL22025158 | 0.85 | TSHR (0.48) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL20194002 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHRCYP3A4LMNATDP1 | |
| SCHEMBL22019966 | 0.83 | TSHR (0.46) | ALDH1A1TSHRCYP3A4LMNATDP1 |
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-2751564-B1 | METHODS OF TRIGGERING ACTIVATION OF ENCAPSULATED SIGNAL-GENERATING SUBSTANCES | JUPITER DIAGNOSTICS HOLDING COMPANY LTD (GB) | 2017-06-07 | — | — | EP | disclosed |