Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 2/20 | 0.42 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 4/20 | 0.36 |
| ▸ | CA9 | Q16790 | 4/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8465017 | 0.84 | HSP90AA1 (0.56) | S100A4PTPRCHSP90AA1HSP90AB1KMT2A | |
| SCHEMBL8464968 | 0.83 | S100A4 (0.43) | S100A4PTPRCLCKIDO1TDO2 | |
| SCHEMBL8465600 | 0.78 | HSP90AA1 (0.52) | S100A4IDO1TDO2HSP90AA1HSP90AB1 | |
| SCHEMBL8466603 | 0.74 | HSP90AA1 (0.63) | S100A4PTPRCHSP90AA1HSP90AB1KMT2A | |
| SCHEMBL8464981 | 0.74 | HSP90AA1 (0.63) | S100A4PTPRCHSP90AA1HSP90AB1KMT2A | |
| SCHEMBL8465123 | 0.74 | S100A4 (0.46) | S100A4PTPRCLCKIDO1TDO2 | |
| SCHEMBL8465211 | 0.74 | S100A4 (0.46) | S100A4PTPRCLCKIDO1TDO2 | |
| SCHEMBL8464828 | 0.69 | HSP90AA1 (0.61) | HSP90AA1HSP90AB1 | |
| SCHEMBL9257330 | 0.68 | S100A4 (0.77) | S100A4PTPRCLCKRECQLCA2 | |
| SCHEMBL11674411 | 0.67 | S100A4 (0.58) | S100A4PTPRCLCKHSP90AA1RECQL |
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-5981544-A | Mono-- or diketone tetracyclic derivatives and therapeutical uses thereof | LABORATOIRE INNOTHERA (FR) | 1999-11-09 | — | — | US | disclosed |