Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.33 |
| ▸ | THRA | P10827 | 5/20 | 0.33 |
| ▸ | THRB | P10828 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14485364 | 0.89 | GABRA1 (0.37) | GABRA1GABRB2S1PR1S1PR3PIN1 | |
| SCHEMBL14498170 | 0.88 | S1PR1 (0.37) | S1PR1S1PR3THRATHRBTSHR | |
| SCHEMBL14497959 | 0.79 | S1PR1 (0.37) | S1PR1S1PR3THRATHRBTSHR | |
| SCHEMBL14485799 | 0.74 | GABRA1 (0.43) | GABRA1GABRB2PIN1TSHR | |
| SCHEMBL17017141 | 0.72 | S1PR1 (0.53) | S1PR1S1PR3TSHRAKR1C3 | |
| SCHEMBL14485230 | 0.71 | GABRA1 (0.41) | GABRA1GABRB2PIN1TSHR | |
| SCHEMBL17345002 | 0.70 | TSHR (0.58) | S1PR1S1PR3TSHRAKR1C3 | |
| SCHEMBL14485074 | 0.69 | ACE2 (0.55) | — | |
| SCHEMBL28873855 | 0.69 | GABRA1 (0.51) | GABRA1GABRB2 | |
| SCHEMBL2464198 | 0.67 | PIN1 (0.49) | PIN1TSHR |
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-7230023-B2 | Water-soluble triazole fungicide | SANKYO COMPANY, LIMITED (JP) | 2007-06-12 | — | — | US | disclosed |