Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.37 |
| ▸ | KIF11 | P52732 | 4/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | CASR | P41180 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL28778794 | 0.76 | TSHR (0.40) | TSHRPNMTKIF11CASRSLC6A2 | |
| SCHEMBL13946948 | 0.74 | TSHR (0.41) | TSHRKIF11HDAC3HDAC1HDAC2 | |
| SCHEMBL5879368 | 0.74 | KIF11 (0.35) | TSHRPNMTKIF11SLC6A4SLC6A3 | |
| SCHEMBL6986308 | 0.73 | TSHR (0.40) | TSHRKIF11CASRSLC6A2SLC6A4 | |
| SCHEMBL9045378 | 0.73 | HTT (0.42) | TSHRKIF11HDAC3HDAC1HDAC2 | |
| SCHEMBL8801308 | 0.73 | HTT (0.42) | TSHRKIF11HDAC3HDAC1HDAC2 | |
| SCHEMBL4026261 | 0.71 | TSHR (0.41) | TSHRKIF11HDAC3HDAC1HDAC2 | |
| SCHEMBL13946950 | 0.71 | TSHR (0.38) | TSHRKIF11HDAC3HDAC1HDAC2 | |
| SCHEMBL11882958 | 0.70 | TSHR (0.40) | TSHRPNMTKIF11 | |
| SCHEMBL4022599 | 0.68 | TSHR (0.39) | TSHRHDAC3HDAC1HDAC2HDAC6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1370520-A1 | ARYL AND BIARYL COMPOUNDS HAVING MCH MODULATORY ACTIVITY | PHARMACOPEIA, INC. (US) | 2003-12-17 | — | — | EP | disclosed |
| WO-2002076929-A1 | ARYL AND BIARYL COMPOUNDS HAVING MCH MODULATORY ACTIVITY | PHARMACOPEIA, INC. (US) | 2002-10-03 | — | — | WO | disclosed |