Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | GHSR | Q92847 | 3/20 | 0.47 |
| ▸ | EDNRB | P24530 | 2/20 | 0.46 |
| ▸ | EDNRA | P25101 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 5/20 | 0.44 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL532980 | 0.87 | JAK2 (0.48) | EDNRAMEN1KMT2AMAPTTP53 | |
| SCHEMBL534052 | 0.83 | MEN1 (0.47) | EDNRBEDNRAMEN1KMT2AMAPT | |
| SCHEMBL532939 | 0.83 | EDNRA (0.43) | EDNRBEDNRAMEN1KMT2AHTR6 | |
| SCHEMBL532038 | 0.83 | ALDH1A1 (0.54) | EDNRBEDNRAKMT2AMAPTTP53 | |
| SCHEMBL533512 | 0.83 | SLC22A12 (0.44) | MEN1KMT2AMAPTTSHR | |
| SCHEMBL5111766 | 0.82 | GFER (0.59) | MEN1KMT2AMAPTTP53TSHR | |
| SCHEMBL533083 | 0.81 | EDNRA (0.46) | HCRTR1EDNRBEDNRAMAPT | |
| SCHEMBL532998 | 0.81 | JAK2 (0.37) | MEN1KMT2AMAPTTP53TSHR | |
| SCHEMBL532999 | 0.81 | TP53 (0.48) | HCRTR1MEN1KMT2ATP53 | |
| SCHEMBL532776 | 0.80 | FFAR4 (0.54) | MEN1KMT2AMAPTTP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2415760-A2 | CCR-9 antagonists | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2012-02-08 | — | — | EP | disclosed |
| US-7319111-B2 | Phenylenediamine Urotensin-II receptor antagonists and CCR-9 antagonists | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2008-01-15 | — | — | US | disclosed |