Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL989764 | 0.84 | TRPA1 (0.38) | TSHRCYP1A2CYP2A6ACHELMNA | |
| SCHEMBL31590141 | 0.83 | KDM4E (0.32) | TSHRACHEMAPT | |
| SCHEMBL28823591 | 0.83 | KDM4E (0.32) | TSHRACHEMAPT | |
| SCHEMBL28634226 | 0.78 | TRPA1 (0.38) | TSHRCYP1A2ACHELMNATRPA1 | |
| SCHEMBL988673 | 0.77 | TSHR (0.37) | TSHRCYP1A2CYP2A6ACHELMNA | |
| SCHEMBL2453373 | 0.76 | TSHR (0.43) | TSHRCYP1A2CYP2A6ACHELMNA | |
| SCHEMBL9319622 | 0.74 | TDP1 (0.37) | TSHRCYP1A2CYP2A6ACHELMNA | |
| SCHEMBL28278745 | 0.74 | TSHR (0.44) | TSHRCYP2A6ACHELMNAALOX12 | |
| SCHEMBL52125 | 0.74 | TSHR (0.44) | TSHRCYP2A6ACHELMNAALOX12 | |
| SCHEMBL28040456 | 0.73 | TSHR (0.33) | TSHRACHELMNAALOX12MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-102666561-B | Transition metal complex, the cyclopentadiene compound of catalyst for trimerization and replacement | SUMITOMO CHEMICAL CO.,LTD. (JP) | 2015-11-25 | — | — | CN | disclosed |