Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 16/20 | 0.51 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL532884 | 0.80 | ACLY (0.52) | ACLYALPLALDH1A1 | |
| SCHEMBL8313600 | 0.78 | BRD4 (0.43) | BRD4KDM4EGLAMEN1ALDH1A1 | |
| SCHEMBL534027 | 0.77 | ACLY (0.55) | ACLY | |
| SCHEMBL533156 | 0.75 | ACLY (0.56) | ACLY | |
| SCHEMBL532952 | 0.74 | ACLY (0.51) | ACLYALPL | |
| SCHEMBL533141 | 0.73 | ACLY (0.63) | ACLY | |
| SCHEMBL14288684 | 0.71 | ACLY (0.53) | ACLY | |
| SCHEMBL3981809 | 0.71 | ACLY (0.46) | ACLYALPL | |
| SCHEMBL532942 | 0.71 | ACLY (0.51) | ACLY | |
| SCHEMBL532815 | 0.70 | ACLY (0.53) | ACLY |
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 |
|---|---|---|---|---|---|---|---|
| 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 |