Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4573788 | 0.85 | TDP1 (0.49) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL11112485 | 0.85 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL2012596 | 0.83 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL2011344 | 0.83 | ALDH1A1 (0.51) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL2007531 | 0.81 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL29369910 | 0.76 | TDP1 (0.74) | ALDH1A1L3MBTL1TDP1MAPK1MAPT | |
| SCHEMBL1694924 | 0.76 | TDP1 (0.74) | ALDH1A1L3MBTL1TDP1MAPK1MAPT | |
| SCHEMBL4775229 | 0.75 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL2007999 | 0.74 | GAA (0.44) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 | |
| SCHEMBL1815302 | 0.74 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1TDP1MAPK1ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008058198-A1 | METHODS OF MAKING COMPOUNDS HAVING A BETA-ADRENERGIC INHIBITOR AND A LINKER AND METHODS OF MAKING COMPOUNDS HAVING A BETA-ADRENERGIC INHIBITOR, A LINKER AND A PHOSPHODIESTERASE INHIBITOR | CARDIOME PHARMA CORP. (CA) | 2008-05-15 | — | — | WO | disclosed |