Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL3260370 | 0.66 | XDH (0.39) | CYP2D6 | |
| SCHEMBL3886600 | 0.65 | CYP1A2 (0.38) | — | |
| SCHEMBL17846433 | 0.65 | NAMPT (0.35) | — | |
| SCHEMBL479504 | 0.64 | CYP1A2 (0.37) | TSHR | |
| SCHEMBL3181459 | 0.62 | PDK2 (0.38) | TSHRSLC6A4 | |
| SCHEMBL1434596 | 0.60 | PIK3C3 (0.39) | — | |
| SCHEMBL20206828 | 0.60 | ALDH1A1 (0.33) | TSHR | |
| SCHEMBL4316722 | 0.59 | CTH (0.42) | — | |
| SCHEMBL342513 | 0.58 | RET (0.43) | — | |
| SCHEMBL2273858 | 0.58 | NOS1 (0.38) | TSHRSLC6A4 |
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-8076338-B2 | Such as 6-(4-phenylpiperazin-1-yl)-9H-purine; cell proliferation/differentiation | EXELIXIS, INC. (US) | 2011-12-13 | — | — | US | disclosed |