Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 2/20 | 0.59 |
| ▸ | RXRB | P28702 | 1/20 | 0.59 |
| ▸ | RXRG | P48443 | 1/20 | 0.59 |
| ▸ | PTPN5 | P54829 | 4/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MDM4 | O15151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL598181 | 0.87 | RXRA (0.66) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL29727265 | 0.85 | RXRA (0.65) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL5355878 | 0.85 | RXRA (0.65) | RXRARXRBRXRGPTPN5HDAC4 | |
| Ethane SCHEMBL6908245 | 0.85 | RXRA (0.63) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL5352034 | 0.85 | RXRA (0.62) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL611807 | 0.83 | RXRA (0.67) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL29681626 | 0.83 | RXRA (0.67) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL14188565 | 0.81 | RXRA (0.65) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL22889067 | 0.80 | RXRA (0.59) | RXRARXRBRXRGPTPN5HDAC4 | |
| SCHEMBL22888510 | 0.80 | RXRA (0.59) | RXRARXRBRXRGPTPN5HDAC4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1268117-A | Novel inhibitors of aggrecanase and matrix metalloproteinases for the treatment of arthritis | DU PONT PHARM CO (US) | 2000-09-27 | — | — | CN | disclosed |
| EP-0114960-A2 | Foliar fertilizers which increase yield of field crop plants which fertilizers contain substituted thiourea, substituted urea | ALLIED CORPORATION (US) | 1984-08-08 | — | — | EP | disclosed |
| US-3989500-A | WITH THIOUREA DERIVATIVES | ALLIED CHEMICAL CORPORATION (US) | 1976-11-02 | — | — | US | disclosed |