Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | IL2 | P60568 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7005090 | 0.87 | HRH3 (0.38) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL7011088 | 0.87 | CYP2D6 (0.36) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL7008171 | 0.86 | HRH3 (0.38) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL7011157 | 0.85 | AKT1 (0.40) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL8876871 | 0.82 | HRH3 (0.36) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL8874752 | 0.81 | HRH3 (0.35) | HRH3CYP2D6KDM4EHTTLMNA | |
| SCHEMBL7009255 | 0.78 | HRH3 (0.40) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL9091097 | 0.78 | HRH3 (0.46) | HRH3CYP2D6IL2KDM4EHTT | |
| Hydrochloric Acid SCHEMBL9308089 | 0.78 | HRH3 (0.42) | HRH3CYP2D6IL2KDM4EHTT | |
| SCHEMBL7009195 | 0.78 | HRH3 (0.42) | HRH3CYP2D6IL2KDM4EHTT |
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-5587504-A | Sulfonyloxy-biphenylcarboxylic ester derivatives which are intermediates | EISAI CO., LTD. (JP) | 1996-12-24 | — | — | US | disclosed |