Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.34 |
| ▸ | DHFR | P00374 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10698849 | 0.85 | PTGER2 (0.46) | PTGER2SLC6A3DHFRPPARGPPARA | |
| SCHEMBL10698433 | 0.76 | DHFR (0.35) | PTPN1SLC6A3DHFRHSD11B1FFAR1 | |
| SCHEMBL10697204 | 0.72 | DHFR (0.41) | PTPN1DHFRHSD11B1 | |
| SCHEMBL11769466 | 0.71 | SLC6A3 (0.49) | SLC6A3DHFRHSD11B1POLB | |
| SCHEMBL10698116 | 0.70 | CYSLTR2 (0.39) | SLC6A3DHFRHSD11B1 | |
| SCHEMBL6879375 | 0.69 | KDM4E (0.37) | PTPN1HSD11B1PPARGPPARA | |
| SCHEMBL11774258 | 0.68 | DHFR (0.42) | SLC6A3DHFRHSD11B1POLB | |
| SCHEMBL13779680 | 0.68 | DHFR (0.44) | SLC6A3DHFRHSD11B1 | |
| SCHEMBL6886057 | 0.68 | CYP4F2 (0.39) | DHFR | |
| SCHEMBL19291655 | 0.67 | DHFR (0.43) | DHFRHSD11B1 |
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-0271287-A2 | Quinoline dioic acids and amides | MERCK FROSST CANADA INC. (CA) | 1988-06-15 | — | — | EP | disclosed |