Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.67 |
| ▸ | HPGD | P15428 | 1/20 | 0.67 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.65 |
| ▸ | NAMPT | P43490 | 3/20 | 0.63 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.61 |
| ▸ | PKM | P14618 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | SGMS2 | Q8NHU3 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL5698795 | 0.87 | PKM (0.77) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL24074161 | 0.84 | TSHR (0.74) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL18132518 | 0.83 | ALDH1A1 (0.72) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL28741286 | 0.83 | FABP4 (0.65) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL14396861 | 0.83 | BRAF (0.58) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL24074163 | 0.82 | TSHR (0.70) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL28687927 | 0.81 | CYP11B2 (0.67) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL30322828 | 0.80 | MEN1 (1.00) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL5311227 | 0.80 | MEN1 (1.00) | TSHRALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL6774617 | 0.79 | CHRNB2 (0.71) | ALDH1A1MEN1KMT2AKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-101321529-B | Diaryl aether derivant as antineoplastic agent | OTSUKA PHARMA CO LTD | 2012-09-05 | — | — | CN | disclosed |
| CN-101321529-A | Diaryl aether derivant as antineoplastic agent | OTSUKA PHARMA CO LTD (JP) | 2008-12-10 | — | — | CN | disclosed |