Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CES2 | O00748 | 3/20 | 0.45 |
| ▸ | CES1 | P23141 | 3/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.39 |
| ▸ | FEN1 | P39748 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6960130 | 0.80 | ALDH1A1 (0.45) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL11111535 | 0.74 | CES2 (0.52) | CA1CA2CES2CES1GSK3B | |
| SCHEMBL7338845 | 0.74 | CA2 (0.43) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL6964785 | 0.70 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL2000442 | 0.64 | CES2 (0.68) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL273857 | 0.64 | CES2 (1.00) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL10697158 | 0.64 | SRD5A2 (0.80) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL9065412 | 0.64 | SRD5A2 (0.80) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL51827 | 0.64 | SRD5A2 (0.80) | CA1CA2CES2CES1ALOX15 | |
| SCHEMBL1681512 | 0.64 | SRD5A2 (0.80) | CA1CA2CES2CES1ALOX15 |
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-5753647-A | PLATELET ACTIVATING FACTOR ANTAGONIST | BOEHRINGER INGELHEIM KG (DE) | 1998-05-19 | — | — | US | disclosed |
| EP-0503471-A1 | Acylaminosubstituted hetrazepines | BOEHRINGER INGELHEIM KG (DE) | 1992-09-16 | — | — | EP | disclosed |