Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | KIF11 | P52732 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | HBB | P68871 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYBB | P04839 | 1/20 | 0.43 |
| ▸ | NOX3 | Q9HBY0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30706974 | 0.93 | PTPN1 (0.59) | PTPN1ESR1KDM4EMAPTBACE1 | |
| SCHEMBL1538767 | 0.93 | PTPN1 (0.59) | PTPN1ESR1KDM4EMAPTBACE1 | |
| SCHEMBL30985267 | 0.93 | PTPN1 (0.59) | PTPN1ESR1KDM4EMAPTBACE1 | |
| SCHEMBL12895889 | 0.93 | BACE1 (0.52) | PTPN1ESR1KDM4EMAPTMEN1 | |
| SCHEMBL12895896 | 0.93 | BACE1 (0.52) | PTPN1ESR1KDM4EMAPTMEN1 | |
| SCHEMBL12277594 | 0.88 | ESR1 (0.49) | PTPN1ESR1KDM4EMAPTMEN1 | |
| SCHEMBL7588186 | 0.87 | BACE1 (0.56) | PTPN1ESR1KDM4EMEN1KMT2A | |
| SCHEMBL13561720 | 0.84 | ALDH1A1 (0.48) | PTPN1ESR1KDM4EMAPTMEN1 | |
| SCHEMBL14189031 | 0.83 | PTPN1 (0.46) | PTPN1ESR1KDM4EMAPTMEN1 | |
| SCHEMBL447064 | 0.82 | PTPN1 (0.48) | PTPN1ESR1KDM4EMAPTMEN1 |
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-4981962-A | CHARGE TRANSFER COMPLEXES | CIBA-GEIGY CORPORATION (US) | 1991-01-01 | — | — | US | disclosed |