Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | NR3C2 | P08235 | 3/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.35 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 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 | |
|---|---|---|---|---|
| SCHEMBL3809239 | 0.81 | RXFP1 (0.36) | CYP1A2CYP2C19RXFP1MAPTNR3C2 | |
| SCHEMBL293972 | 0.74 | GSK3A (0.44) | CYP1A2CYP2C19RXFP1MAPTALDH1A1 | |
| SCHEMBL293902 | 0.70 | GSK3A (0.44) | RXFP1MAPTALDH1A1HPGDPLA2G2A | |
| SCHEMBL293409 | 0.66 | GSK3A (0.44) | CYP1A2CYP2C19RXFP1MAPTALDH1A1 | |
| SCHEMBL8259769 | 0.65 | NR3C2 (0.48) | NR3C2 | |
| SCHEMBL5449059 | 0.62 | GCGR (0.47) | L3MBTL1ALDH1A1HPGDPOLBGAA | |
| SCHEMBL3817263 | 0.62 | POLB (0.40) | MAPTL3MBTL1ALDH1A1ARHPGD | |
| SCHEMBL5442554 | 0.61 | DPP4 (0.51) | MAPTL3MBTL1ALDH1A1HPGDPOLB | |
| SCHEMBL21817786 | 0.60 | CFTR (0.43) | NR3C2L3MBTL1ALDH1A1HPGDWDR5 | |
| SCHEMBL21817631 | 0.60 | WDR5 (0.47) | KDM4EWDR5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1828135-A4 | COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES | IRM LLC (BM) | 2009-08-12 | — | — | EP | claimed |
| EP-1828135-A2 | COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES | IRM, LLC (BM) | 2007-09-05 | — | — | EP | claimed |
| WO-2006066011-A2 | COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES | IRM LLC (BM) | 2006-06-22 | — | — | WO | claimed |