Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4637001 | 0.69 | — | — | |
| SCHEMBL4356813 | 0.64 | CYP19A1 (0.36) | TSHRNPSR1CYP19A1 | |
| SCHEMBL1322984 | 0.64 | CYP19A1 (0.36) | TSHRNPSR1CYP19A1 | |
| SCHEMBL1325877 | 0.64 | CYP19A1 (0.36) | TSHRNPSR1CYP19A1 | |
| SCHEMBL10028354 | 0.64 | — | — | |
| SCHEMBL10025159 | 0.64 | — | — | |
| SCHEMBL3255645 | 0.62 | — | — | |
| SCHEMBL13805603 | 0.61 | TSHR (0.44) | TSHRNPSR1CYP19A1 | |
| SCHEMBL10057858 | 0.60 | TSHR (0.35) | TSHRNPSR1CYP19A1 | |
| SCHEMBL709055 | 0.60 | TSHR (0.35) | TSHRNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9802165-B2 | 3D expanding geometry | THE UNIVERSITY OF LEEDS (GB) | 2017-10-31 | — | — | US | disclosed |
| US-20140321231-A1 | 3D EXPANDING GEOMETRY | THE UNIVERSITY OF LEEDS (GB) | 2014-10-30 | — | — | US | disclosed |