Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.45 |
| ▸ | GABRG2 | P18507 | 4/20 | 0.45 |
| ▸ | GABRB3 | P28472 | 4/20 | 0.45 |
| ▸ | GABRA5 | P31644 | 4/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 4/20 | 0.45 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.45 |
| ▸ | GABRP | O00591 | 2/20 | 0.45 |
| ▸ | GABRD | O14764 | 2/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.45 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.45 |
| ▸ | GABRE | P78334 | 2/20 | 0.45 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.45 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8548287 | 0.86 | GABRA1 (0.46) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8546583 | 0.85 | TUBB4A (0.45) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8547179 | 0.85 | GABRA1 (0.45) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8553124 | 0.82 | GABRA1 (0.43) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8591475 | 0.80 | PTPN1 (0.42) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8553338 | 0.79 | ALDH1A1 (0.47) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8551159 | 0.78 | GABRA1 (0.42) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8548277 | 0.78 | GABRA1 (0.42) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8549182 | 0.78 | GABRA1 (0.47) | KDM4EALDH1A1HPGDMAPTNPC1 | |
| SCHEMBL8552525 | 0.78 | ELANE (0.38) | KDM4EALDH1A1HPGDMAPTNPC1 |
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-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |