Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL18507949 | 0.79 | TSHR (0.37) | PIK3CDTDP1TSHR | |
| SCHEMBL9250509 | 0.79 | CHRM2 (0.42) | PIK3CDALDH1A1CA12CA1CA2 | |
| SCHEMBL4540778 | 0.77 | CYP3A4 (0.36) | PIK3CDALDH1A1TSHR | |
| SCHEMBL12287122 | 0.76 | ALDH1A1 (0.39) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL7534859 | 0.75 | PIK3CD (0.33) | PIK3CD | |
| SCHEMBL23121481 | 0.74 | ALDH1A1 (0.37) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL12990704 | 0.74 | ALDH1A1 (0.37) | PIK3CDALDH1A1CA12CA1CA2 | |
| SCHEMBL28731356 | 0.74 | ALDH1A1 (0.42) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL8892243 | 0.74 | ALDH1A1 (0.37) | PIK3CDALDH1A1CA12CA1CA2 | |
| SCHEMBL9428069 | 0.74 | ALDH1A1 (0.37) | ALDH1A1CA12CA1CA2CA9 |
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-2012003478-A2 | DETECTING TARGETS USING MASS TAGS AND MASS SPECTROMETRY | VENTANA MEDICAL SYSTEMS, INC. (US) | 2012-01-05 | — | — | WO | disclosed |