Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 3/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 4/20 | 0.38 |
| ▸ | HTR2C | P28335 | 4/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL798146 | 0.85 | DRD1 (0.42) | CYP11B2CYP11B1HTR2AHTR2CHTR2B | |
| SCHEMBL793623 | 0.83 | MAPT (0.52) | HTR2CMAPTALDH1A1LMNAMAPK1 | |
| SCHEMBL798654 | 0.79 | PDGFRB (0.43) | CYP11B2CYP11B1PDGFRBKDR | |
| SCHEMBL793143 | 0.76 | GRIN2D (0.42) | CYP11B2CYP11B1PDGFRBKDRMAPT | |
| SCHEMBL793875 | 0.76 | TRPV3 (0.41) | HTR2AHTR2CPDGFRBKDRPDE10A | |
| SCHEMBL794272 | 0.76 | PHGDH (0.43) | HTR2AHTR2CPDGFRBKDRPDE10A | |
| SCHEMBL807910 | 0.75 | CYP11B2 (0.59) | CYP11B2CYP11B1HTR2AHTR2CHTR2B | |
| SCHEMBL798533 | 0.74 | TIPARP (0.46) | CYP11B2CYP11B1PDGFRBKDRMAPT | |
| SCHEMBL798567 | 0.71 | CYP17A1 (0.44) | CYP17A1 | |
| SCHEMBL16486036 | 0.71 | NPY5R (0.37) | CYP11B2CYP11B1PDGFRBKDRMAPT |
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-2627648-A1 | 17aHYDROXYLASE/C17,20-LYASE INHIBITORS | Novartis AG (CH) | 2013-08-21 | — | — | EP | disclosed |
| WO-2012035078-A1 | 17α-HYDROXYLASE/C17,20-LYASE INHIBITORS | NOVARTIS AG (CH) | 2012-03-22 | — | — | WO | disclosed |