Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL3918824 | 0.79 | ENPP1 (0.42) | SLC6A5HTTCDK1ENPP1LMNA | |
| SCHEMBL3918172 | 0.71 | EGFR (0.37) | HTTKDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL48258 | 0.66 | ERAP1 (0.61) | SLC6A5ACHEGDALMNAMAPT | |
| SCHEMBL12779523 | 0.65 | GDA (0.42) | SLC6A5ACHEGDAMAPT | |
| SCHEMBL7075412 | 0.61 | SMN1; SMN2 (0.45) | SLC6A5LMNAALDH1A1HPGD | |
| SCHEMBL18785375 | 0.61 | SLC6A5 (0.48) | SLC6A5ACHEGDALMNAKDM4E | |
| SCHEMBL2398078 | 0.61 | SLC6A5 (0.44) | SLC6A5ACHEGDAMAPT | |
| SCHEMBL12609108 | 0.61 | PDE4A (0.52) | EGFR | |
| SCHEMBL21895410 | 0.57 | AURKA (0.45) | ACHEGDAMAPT | |
| SCHEMBL530898 | 0.55 | GDA (0.70) | ACHEGDALMNAALDH1A1MAPT |
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-2024020333-A2 | KINASE INHIBITORS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2024-01-25 | — | — | WO | disclosed |