Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.40 |
| ▸ | ICMT | O60725 | 2/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | PLA2G4A | P47712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8327081 | 0.94 | ICMT (0.43) | ESR1ESR2ICMTAKR1C3TP53 | |
| SCHEMBL8329222 | 0.92 | ICMT (0.42) | ICMTTP53MAPTP2RX3AGTR1 | |
| SCHEMBL8327100 | 0.88 | AGTR1 (0.49) | AGTR1AGTR2 | |
| SCHEMBL8329353 | 0.88 | ICMT (0.43) | ICMTTP53MAPTP2RX3AGTR1 | |
| SCHEMBL8328934 | 0.86 | CHRM1 (0.47) | ICMTTP53 | |
| SCHEMBL8324163 | 0.85 | ICMT (0.45) | ICMTTP53MAPTAGTR1AGTR2 | |
| SCHEMBL8330654 | 0.83 | ICMT (0.40) | ICMTTP53MAPTAGTR1AGTR2 | |
| SCHEMBL8328867 | 0.82 | AGTR1 (0.49) | AGTR1AGTR2 | |
| SCHEMBL8327078 | 0.82 | AGTR1 (0.49) | AGTR1AGTR2 | |
| SCHEMBL8322474 | 0.81 | AGTR1 (0.41) | ICMTTP53MAPTAGTR1AGTR2 |
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-0498721-B1 | N-substituted quinoline derivatives, process for their preparation, their use as pharmaceuticals and pharmaceutical compositions containing them | HOECHST MARION ROUSSEL INC (FR) | 1999-12-22 | — | — | EP | claimed |