Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 3/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.42 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.42 |
| ▸ | TDP2 | O95551 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | CASP7 | P55210 | 1/20 | 0.42 |
| ▸ | CASP9 | P55211 | 1/20 | 0.42 |
| ▸ | CASP6 | P55212 | 1/20 | 0.42 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.42 |
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6446225 | 0.84 | TSHR (0.57) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL7439402 | 0.83 | TSHR (0.47) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL22799646 | 0.80 | TSHR (0.40) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL22799721 | 0.78 | CYP2A6 (0.45) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL22799901 | 0.78 | CYP2A6 (0.45) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL22799843 | 0.78 | CYP2A6 (0.45) | TSHRCA12CA9PARP1PDPK1 | |
| SCHEMBL348705 | 0.76 | MAPT (0.50) | TSHR | |
| SCHEMBL7551415 | 0.76 | MAPT (0.50) | TSHR | |
| SCHEMBL14306724 | 0.76 | MAPT (0.50) | TSHR | |
| SCHEMBL7444393 | 0.75 | ANPEP (0.41) | TSHRPARP1TDP2CASP3CASP7 |
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-5098888-A | Cholinergic agents and antispasmodic agents | ADIR ET COMPAGNIE (FR) | 1992-03-24 | — | — | US | disclosed |