Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRPF1 | P55201 | 1/20 | 0.52 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.45 |
| ▸ | UQCRB | P14927 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CCR9 | P51686 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL532836 | 0.89 | HSD17B2 (0.42) | BRPF1HSD17B2UQCRBLMNAGAA | |
| SCHEMBL14288685 | 0.88 | HSD11B1 (0.45) | BRPF1HSD17B2UQCRBLMNAALDH1A1 | |
| SCHEMBL533017 | 0.87 | FFAR4 (0.55) | LMNAGAAALDH1A1KDM4EMAPT | |
| SCHEMBL533437 | 0.85 | CYTH2 (0.49) | LMNAGAAALDH1A1KDM4EMAPT | |
| SCHEMBL533055 | 0.85 | ALDH1A1 (0.45) | ALDH1A1KDM4EMAPTMEN1CYP3A4 | |
| SCHEMBL532880 | 0.85 | FFAR4 (0.56) | LMNAGAAALDH1A1MAPTMEN1 | |
| SCHEMBL533666 | 0.85 | FFAR4 (0.56) | LMNAGAAALDH1A1MAPTMEN1 | |
| SCHEMBL532776 | 0.85 | FFAR4 (0.54) | LMNAGAAALDH1A1MAPTMEN1 | |
| SCHEMBL532953 | 0.83 | FFAR4 (0.59) | ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL534816 | 0.83 | MAPT (0.41) | BRPF1LMNAALDH1A1KDM4EMAPT |
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 5 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 |
| US-7319111-B2 | Phenylenediamine Urotensin-II receptor antagonists and CCR-9 antagonists | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2008-01-15 | — | — | US | disclosed |
| US-7319111-B2 | Phenylenediamine Urotensin-II receptor antagonists and CCR-9 antagonists | ENCYSIVE PHARMACEUTICALS, INC. (US) | 2008-01-15 | — | — | US | disclosed |
| WO-2004073634-A2 | PHENYLENEDIAMINE UROTENSIN-II RECEPTOR ANTAGONISTS AND CCR-9 ANTAGONISTS | ENCYSIVE PHARMACEUTICALS INC. (US) | 2004-09-02 | — | — | WO | disclosed |