Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL10037957 | 0.94 | S1PR3 (0.32) | S1PR3 | |
| SCHEMBL137087 | 0.92 | PTPN1 (0.30) | PTPN1 | |
| SCHEMBL8116380 | 0.91 | PTPN1 (0.33) | PTPN1 | |
| SCHEMBL178258 | 0.89 | ALDH1A1 (0.32) | — | |
| SCHEMBL15246873 | 0.88 | ADRB2 (0.30) | — | |
| SCHEMBL13351848 | 0.88 | MEN1 (0.39) | — | |
| SCHEMBL12617278 | 0.88 | MEN1 (0.39) | — | |
| SCHEMBL4999573 | 0.87 | ADRB2 (0.30) | — | |
| SCHEMBL1797108 | 0.87 | MEN1 (0.39) | — | |
| SCHEMBL12952231 | 0.86 | ADRB2 (0.32) | PTPN1 |
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-2426488-B1 | MEASUREMENT METHOD UTILIZING INTERNAL STANDARD SUBSTANCE | WAKO PURE CHEM IND LTD (JP) | 2016-04-20 | — | — | EP | disclosed |
| EP-2426123-B1 | PYRAZOLE-BASED CYANINE DYE CONTAINING QUATERNARY AMMONIUM CATION | WAKO PURE CHEM IND LTD (JP) | 2014-08-06 | — | — | EP | disclosed |