Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.51 |
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | SOD1 | P00441 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.49 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28853764 | 0.83 | RXRA (0.73) | HDAC1HDAC2MRGPRX4RXRARXRB | |
| SCHEMBL14280100 | 0.83 | LTA4H (0.54) | LTA4HBACE1SOD1HDAC1HDAC2 | |
| SCHEMBL4737237 | 0.82 | TP53 (0.45) | MAOB | |
| SCHEMBL7459312 | 0.80 | LSS (0.50) | LTA4HHDAC1HDAC2HRH3 | |
| SCHEMBL31533357 | 0.80 | LSS (0.50) | LTA4HHDAC1HDAC2HRH3 | |
| SCHEMBL1714596 | 0.79 | — | — | |
| SCHEMBL30338775 | 0.79 | RXRA (0.70) | LTA4HBACE1SOD1RXRARXRB | |
| SCHEMBL3657427 | 0.79 | LTA4H (0.51) | LTA4HBACE1SOD1HDAC1HDAC2 | |
| SCHEMBL1912740 | 0.79 | AGXT (0.53) | LTA4HBACE1SOD1HDAC1HDAC2 | |
| SCHEMBL534849 | 0.79 | LTA4H (0.51) | LTA4HBACE1SOD1HDAC1HDAC2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244617-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | Ortho-McNeil Pharmaceutical, Inc. (US) | 2002-10-02 | — | — | EP | disclosed |
| WO-2001047875-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-07-05 | — | — | WO | disclosed |