Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | GPR132 | Q9UNW8 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | F9 | P00740 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28048524 | 0.91 | MAPK1 (0.64) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL7311175 | 0.84 | MAPK1 (0.65) | MAPK1GPR132MEN1KMT2AHTR1A | |
| SCHEMBL8881389 | 0.83 | HTT (0.62) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL171895 | 0.83 | MAPK1 (0.56) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL18297474 | 0.83 | APP (0.58) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL30354931 | 0.83 | MAOB (0.62) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL3761776 | 0.83 | MAOB (0.62) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL8361615 | 0.83 | MAPK1 (0.56) | MAPK1CYP19A1CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL4060132 | 0.83 | MAPK1 (0.56) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 | |
| SCHEMBL5392025 | 0.81 | MAPK1 (0.58) | MAPK1CYP19A1CYP11B1CYP11B2GPR132 |
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-0707564-B1 | DIFLUORO STATONE ANALOGS | MERRELL PHARMA INC (US) | 2000-09-20 | — | — | EP | claimed |
| US-5948778-A | Difluoro statone antiviral analogs | MERREL PHARMACEUTICALS INC. (US) | 1999-09-07 | — | — | US | claimed |