Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.41 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | AKT2 | P31751 | 1/20 | 0.40 |
| ▸ | MYC | P01106 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | RXRA | P19793 | 1/20 | 0.37 |
| ▸ | RXRB | P28702 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18945760 | 0.88 | ALDH1A1 (0.48) | KDM4EL3MBTL1ALDH1A1LMNAGAA | |
| SCHEMBL1878563 | 0.78 | KDM4E (0.55) | TDP1MEN1KMT2AKDM4EL3MBTL1 | |
| SCHEMBL18945307 | 0.76 | ALDH1A1 (0.43) | MEN1KMT2AKDM4EL3MBTL1ALDH1A1 | |
| SCHEMBL18945912 | 0.76 | CDH1 (0.49) | KDM4EL3MBTL1ALDH1A1LMNAGAA | |
| SCHEMBL18945818 | 0.74 | KDM4E (0.53) | KDM4EL3MBTL1ALDH1A1LMNAGAA | |
| SCHEMBL9953088 | 0.74 | MAPK14 (0.49) | KDM4EL3MBTL1RXRARXRBNR4A2 | |
| SCHEMBL18945661 | 0.74 | ERBB2 (0.40) | TDP1KDM4EALDH1A1GAAERBB2 | |
| SCHEMBL18597446 | 0.72 | PSMB5 (0.34) | MEN1KMT2AKDM4EALDH1A1LMNA | |
| SCHEMBL12146693 | 0.71 | GPR84 (0.45) | TDP1MEN1KMT2AKDM4EL3MBTL1 | |
| SCHEMBL12146720 | 0.71 | GPR84 (0.45) | TDP1MEN1KMT2AKDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2661428-B1 | QUINOXALINES AND AZA-QUINOXALINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2017-06-07 | — | — | EP | disclosed |