Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19291655 | 0.86 | DHFR (0.43) | DHFRHSD11B1BCHEKDM4C | |
| SCHEMBL2205030 | 0.85 | DHFR (0.45) | DHFRHSD11B1 | |
| SCHEMBL13779680 | 0.82 | DHFR (0.44) | DHFRHSD11B1BCHEKDM4C | |
| SCHEMBL8903203 | 0.80 | DHFR (0.42) | DHFRHSD11B1BCHEKDM4C | |
| SCHEMBL10698433 | 0.79 | DHFR (0.35) | DHFRHSD11B1PTPN1BCHE | |
| SCHEMBL10698849 | 0.78 | PTGER2 (0.46) | DHFRBCHE | |
| SCHEMBL9119543 | 0.77 | DHFR (0.39) | DHFRBCHE | |
| SCHEMBL12432781 | 0.77 | DHFR (0.38) | DHFRBCHE | |
| SCHEMBL3964542 | 0.76 | DHFR (0.45) | DHFRHSD11B1KDM4C | |
| SCHEMBL411867 | 0.76 | DHFR (0.46) | DHFRHSD11B1PTPN1KDM4C |
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 |