Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL1301840 | 0.88 | CYP3A4 (0.38) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL1301839 | 0.88 | CYP3A4 (0.38) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL11039206 | 0.85 | ALDH1A1 (0.46) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL11039208 | 0.85 | ALDH1A1 (0.46) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL12981293 | 0.82 | ALDH1A1 (0.36) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL15272366 | 0.82 | ALDH1A1 (0.36) | CYP3A4LMNAUSP2MAPTSMN1; SMN2 | |
| SCHEMBL10385500 | 0.81 | — | — | |
| SCHEMBL10385502 | 0.81 | — | — | |
| SCHEMBL10386041 | 0.77 | ALDH1A1 (0.44) | LMNASMN1; SMN2ALDH1A1ALOX15HSD17B10 | |
| SCHEMBL1302474 | 0.77 | ALDH1A1 (0.39) | LMNASMN1; SMN2ALDH1A1ALOX15HSD17B10 |
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-6049005-A | REACTING ALKOXYCARBONYL BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF CATATLYST COMPRISING PALLADIUM AND ORGANIC PHOSPHINE LIGAND | DSM N.V. (NL) | 2000-04-11 | — | — | US | disclosed |