Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL2773468 | 0.96 | CYP1A2 (0.40) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL28394907 | 0.87 | CYP1A2 (0.35) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL6513710 | 0.79 | CYP1A2 (0.38) | CYP1A2CA12CA1CA2CA7 | |
| Mellitic Acid SCHEMBL28758936 | 0.76 | CYP1A2 (0.47) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL6519677 | 0.76 | CYP1A2 (0.36) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL6515457 | 0.76 | CYP1A2 (0.36) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL8757912 | 0.72 | LDHA (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL25396101 | 0.71 | CYP1A2 (0.33) | CYP1A2CA12CA1CA2CA7 | |
| Mellitic Acid SCHEMBL22971 | 0.71 | CYP1A2 (0.50) | CYP1A2CA12CA1CA2CA7 | |
| Mellitic Acid SCHEMBL23507 | 0.71 | CYP1A2 (0.50) | CYP1A2CA12CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-4026905-A | Electrically conducting organic salts | MONSANTO COMPANY (US) | 1977-05-31 | — | — | US | disclosed |