Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.32 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29407128 | 0.79 | ESR1 (0.37) | ESR1ESR2RECQLS1PR3S1PR1 | |
| SCHEMBL29989028 | 0.79 | ESR1 (0.44) | ESR1ESR2S1PR3S1PR1NPC1 | |
| SCHEMBL5109247 | 0.79 | ESR1 (0.44) | ESR1ESR2S1PR3S1PR1NPC1 | |
| SCHEMBL2153037 | 0.79 | ESR1 (0.37) | ESR1ESR2RECQLS1PR3S1PR1 | |
| SCHEMBL3916038 | 0.79 | ESR1 (0.41) | ESR1ESR2S1PR3S1PR1NPC1 | |
| SCHEMBL23525242 | 0.76 | ESR1 (0.42) | ESR1ESR2RECQLS1PR3S1PR1 | |
| SCHEMBL31541690 | 0.73 | ESR1 (0.40) | ESR1ESR2S1PR3S1PR1NPC1 | |
| SCHEMBL453717 | 0.71 | — | — | |
| SCHEMBL29258492 | 0.70 | KDM1A (0.43) | RECQLNPC1RAB9AMKNK1MKNK2 | |
| SCHEMBL4140258 | 0.69 | CCR1 (0.41) | RECQLNPC1POLBRAB9AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-103237800-A | Amide derivatives and use thereof | MITSUBISHI TANABE PHARMA CORP | 2013-08-07 | — | — | CN | disclosed |