Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GRM8 | O00222 | 1/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL6844820 | 0.91 | CA1 (0.43) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL901296 | 0.79 | CA1 (0.53) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL1525906 | 0.79 | CA1 (0.53) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL7064128 | 0.77 | CA1 (0.61) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL6844822 | 0.76 | CA1 (0.47) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL13980850 | 0.76 | CA1 (0.56) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL6041195 | 0.74 | CA1 (0.57) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL6041202 | 0.74 | CA1 (0.57) | CA1CA2CES2CES1ALDH1A1 | |
| SCHEMBL5746270 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1MAPTKMT2ASMN1; SMN2 | |
| SCHEMBL5746268 | 0.73 | ALDH1A1 (0.41) | ALDH1A1TDP1MAPTKMT2ASMN1; SMN2 |
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-2012085080-A1 | METHOD OF DETECTING A PROTEOLYTIC ENZYME BY MEANS OF GOLD NANOPARTICLES- CATALYZED AMPLIFICATION OF A SIGNAL | UNIVERSITA' DEGLI STUDI DI PADOVA (IT) | 2012-06-28 | — | — | WO | disclosed |