Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL499008 | 0.77 | CES1 (0.35) | HTTLMNAMAPK1MEN1KMT2A | |
| SCHEMBL499002 | 0.64 | AKR1A1 (0.33) | KDM4EALDH1A1 | |
| SCHEMBL499001 | 0.64 | AKR1A1 (0.33) | KDM4EALDH1A1 | |
| SCHEMBL499012 | 0.64 | AKR1A1 (0.33) | KDM4EALDH1A1 | |
| SCHEMBL499153 | 0.62 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL499154 | 0.62 | SMN1; SMN2 (0.38) | — | |
| SCHEMBL499085 | 0.61 | KDM4E (0.36) | BACE1MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL30452208 | 0.60 | MAP3K14 (0.37) | HTR2AHTR2CMEN1KMT2AALDH1A1 | |
| SCHEMBL9539065 | 0.59 | AKR1B1 (0.45) | BACE1MEN1KMT2A | |
| SCHEMBL7690850 | 0.57 | L3MBTL1 (0.58) | LMNADRD2DRD4DRD3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008156816-A2 | RENIN INHIBITORS | VITAE PHARMACEUTICALS, INC. (US) | 2008-12-24 | — | — | WO | disclosed |