Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTNNB1 | P35222 | 1/20 | 0.38 |
| ▸ | WNT3A | P56704 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL8524027 | 0.91 | PARP1 (0.39) | PARP1CYP2C19NOTUMTSHRSMN1; SMN2 | |
| SCHEMBL448796 | 0.88 | TSHR (0.44) | CTNNB1WNT3ATSHRSMN1; SMN2CA12 | |
| SCHEMBL29631558 | 0.88 | TSHR (0.44) | CTNNB1WNT3ATSHRSMN1; SMN2CA12 | |
| SCHEMBL1172393 | 0.88 | TSHR (0.44) | CTNNB1WNT3ATSHRSMN1; SMN2CA12 | |
| SCHEMBL3950945 | 0.82 | TSHR (0.48) | TSHRSMN1; SMN2 | |
| SCHEMBL3952970 | 0.80 | TSHR (0.46) | TSHRSMN1; SMN2 | |
| SCHEMBL29788643 | 0.80 | MAOA (0.41) | TSHRSMN1; SMN2NISCHCA12CA1 | |
| SCHEMBL29788642 | 0.80 | MAOA (0.41) | TSHRSMN1; SMN2NISCHCA12CA1 | |
| SCHEMBL895328 | 0.80 | MAOA (0.41) | TSHRSMN1; SMN2NISCHCA12CA1 | |
| SCHEMBL107468 | 0.80 | MAOA (0.41) | TSHRSMN1; SMN2NISCHCA12CA1 |
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-2006060082-A1 | TRICYCLIC COMPOUNDS, PREPARATION THEREOF AND USE THEREOF AS CHOLINESTERASE ACTIVITY INHIBITORS | THE GOVERNMENT OF THE U.S.A. as represented by THE SEC., DEPT. OF HEALTH & HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH (US) | 2006-06-08 | — | — | WO | disclosed |