Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 1/20 | 0.42 |
| ▸ | ALPI | P09923 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8025715 | 0.71 | DDAH1 (0.61) | RAB9AKDM4ENPC1KMT2ADDAH1 | |
| SCHEMBL30207649 | 0.71 | DDAH1 (0.61) | RAB9AKDM4ENPC1KMT2ADDAH1 | |
| SCHEMBL4134081 | 0.71 | EPHX1 (0.44) | CYP1A2CYP2D6ALPI | |
| SCHEMBL2202858 | 0.71 | DDAH1 (0.46) | RAB9ALMNATSHRNPC1KMT2A | |
| SCHEMBL2202852 | 0.71 | DDAH1 (0.46) | RAB9ALMNATSHRNPC1KMT2A | |
| SCHEMBL20677814 | 0.70 | DDAH1 (0.63) | RAB9AKDM4ETSHRNPC1KMT2A | |
| SCHEMBL825212 | 0.70 | RAB9A (0.57) | RAB9AKDM4ELMNATSHRNPC1 | |
| SCHEMBL20237230 | 0.69 | RAB9A (0.56) | RAB9AKDM4ENPC1KMT2ADDAH1 | |
| SCHEMBL1968720 | 0.69 | RAB9A (0.52) | RAB9AKDM4ELMNATSHRNPC1 | |
| SCHEMBL230157 | 0.68 | POLB (0.84) | RAB9ANPC1DDAH1POLBMAPT |
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-1896032-B1 | THE PREPARATION AND USE OF COMPOUNDS AS PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2012-10-31 | — | — | EP | disclosed |
| WO-2006138265-A2 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS, PREPARATION AND USE THEREOF | SCHERING CORPORATION (US) | 2006-12-28 | — | — | WO | disclosed |