Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.44 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.44 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18863400 | 0.92 | PTPN1 (0.50) | PTPN1KMT2ACYP3A4HSD17B10ALDH1A1 | |
| SCHEMBL18876836 | 0.84 | PTPN1 (0.39) | PTPN1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL18876835 | 0.80 | PTPN1 (0.44) | PTPN1MAPTKMT2ACYP3A4HSD17B10 | |
| SCHEMBL18880277 | 0.78 | PTPN1 (0.38) | PTPN1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL18880279 | 0.72 | ALOX5 (0.37) | PTPN1MAPTKMT2AKDM4EMEN1 | |
| SCHEMBL5791635 | 0.69 | MAOB (0.69) | GABRA1GABRG2GABRB3GABRA3GABRA2 | |
| SCHEMBL11504762 | 0.69 | GABRA1 (0.78) | PTPN1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL30979262 | 0.69 | GABRA1 (0.63) | PTPN1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL29215244 | 0.69 | GABRA1 (0.63) | PTPN1GABRA1GABRG2GABRB3GABRA3 | |
| SCHEMBL5569576 | 0.69 | ALDH1A1 (0.42) | CYP3A4ALDH1A1USP2SMN1; SMN2CALM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170149080-A1 | PHOSPHONIUM CATIONS AND POLYMERS INCORPORATING THEM | UNIVERSITY OF DELAWARE (US) | 2017-05-25 | — | — | US | disclosed |