Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 2/20 | 0.33 |
| ▸ | YTHDF2 | Q9Y5A9 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.31 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL8404435 | 0.76 | ADORA2A (0.47) | CYP1A2HSD17B10ADORA2AADORA2BPDE2A | |
| SCHEMBL20434719 | 0.75 | CHEK1 (0.46) | CYP3A4CLK4ADORA2AADORA2BKDM4E | |
| SCHEMBL25677897 | 0.73 | ADORA2A (0.33) | ADORA2AADORA2BKDM4ENPC1ALDH1A1 | |
| SCHEMBL25667856 | 0.73 | ADORA2A (0.33) | ADORA2AADORA2BKDM4ENPC1ALDH1A1 | |
| SCHEMBL25667714 | 0.73 | ADORA2A (0.37) | ADORA2AADORA2BKDM4ENPC1ALDH1A1 | |
| SCHEMBL25669560 | 0.73 | ADORA2A (0.33) | ADORA2AADORA2BKDM4ENPC1ALDH1A1 | |
| SCHEMBL25667807 | 0.73 | ADORA2A (0.33) | USP2ALOX15ADORA2AADORA2BKDM4E | |
| SCHEMBL25669809 | 0.70 | POLB (0.35) | ADORA2AADORA2BPDE2APDE3BPDE3A | |
| SCHEMBL25667671 | 0.70 | ADRA2A (0.38) | YTHDC1YTHDF2PDE2APDE3BPDE3A | |
| SCHEMBL22239632 | 0.68 | ADORA1 (0.44) | ADORA2AKDM4ESMN1; SMN2 |
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-2018068017-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF RAS AND METHODS OF USE THEREOF | ARAXES PHARMA LLC (US) | 2018-04-12 | — | — | WO | disclosed |