Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | AR | P10275 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CFTR | P13569 | 6/20 | 0.46 |
| ▸ | CCR2 | P41597 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4504902 | 0.89 | AR (0.57) | ALDH1A1KDM4ELMNAARMAPT | |
| SCHEMBL4494579 | 0.85 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAHPGDAR | |
| SCHEMBL4559832 | 0.84 | TP53 (0.46) | ALDH1A1GAALMNAHPGDMAPT | |
| SCHEMBL4490747 | 0.84 | PGR (0.43) | PGRALDH1A1GAAKDM4ELMNA | |
| SCHEMBL4485732 | 0.82 | KMT2A (0.47) | CCR2FEN1PLA2G2AKMT2A | |
| SCHEMBL4484664 | 0.81 | CFTR (0.45) | ALDH1A1LMNAARCFTRCCR2 | |
| SCHEMBL4485664 | 0.78 | KDM4E (0.40) | ALDH1A1KDM4ELMNAMAPTSMN1; SMN2 | |
| SCHEMBL4490040 | 0.76 | GFER (0.47) | ALDH1A1GAAKDM4EHPGDMAPT | |
| SCHEMBL4492336 | 0.75 | AR (0.47) | ALDH1A1GAAKDM4ELMNAHPGD | |
| SCHEMBL4504869 | 0.74 | ALDH1A1 (0.42) | ALDH1A1LMNAMAPTSMN1; SMN2KMT2A |
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-7504429-B2 | Tyrosine kinase inhibitors | MERCK & CO., INC. (US) | 2009-03-17 | — | — | US | claimed |