Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL7306902 | 0.93 | SMN1; SMN2 (0.40) | CYP1A2SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL7313193 | 0.91 | SIGMAR1 (0.33) | SMN1; SMN2SIGMAR1 | |
| SCHEMBL7303823 | 0.91 | PAOX (0.35) | CYP1A2SMN1; SMN2ALDH1A1LMNAGAA | |
| SCHEMBL7309061 | 0.88 | HSD17B10 (0.35) | CYP1A2SMN1; SMN2KDM4EALDH1A1RECQL | |
| SCHEMBL7316521 | 0.85 | SMN1; SMN2 (0.41) | SMN1; SMN2KDM4EALDH1A1 | |
| SCHEMBL7317112 | 0.85 | OPRL1 (0.38) | ALDH1A1LMNA | |
| SCHEMBL7310453 | 0.85 | OPRL1 (0.34) | KDM4EALDH1A1LMNAGAA | |
| SCHEMBL7305487 | 0.85 | ALDH1A1 (0.42) | SMN1; SMN2ALDH1A1SIGMAR1 | |
| SCHEMBL7305758 | 0.85 | SIGMAR1 (0.36) | SIGMAR1 | |
| SCHEMBL7304274 | 0.84 | SMN1; SMN2 (0.34) | SMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0711770-A1 | Antagonists of adhesion receptors | MERCK PATENT GmbH (DE) | 1996-05-15 | — | — | EP | disclosed |