Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.50 |
| ▸ | RARB | P10826 | 5/20 | 0.48 |
| ▸ | RARA | P10276 | 1/20 | 0.48 |
| ▸ | CCR2 | P41597 | 2/20 | 0.46 |
| ▸ | CCR7 | P32248 | 1/20 | 0.46 |
| ▸ | CCR3 | P51677 | 1/20 | 0.44 |
| ▸ | CCR4 | P51679 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6342767 | 0.97 | CCR5 (0.48) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6343483 | 0.96 | CCR5 (0.50) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6340856 | 0.94 | CCR5 (0.51) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL5654599 | 0.94 | CCR5 (0.55) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6340959 | 0.93 | CCR5 (0.49) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6344598 | 0.91 | CCR5 (0.51) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6347342 | 0.91 | CCR5 (0.52) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6341615 | 0.90 | CCR5 (0.48) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL17870854 | 0.90 | CCR5 (0.58) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL17870855 | 0.90 | CCR5 (0.58) | CCR5RARBRARACCR2CCR7 |
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-6936602-B1 | Benzazepine derivatives, process for the preparation of the same and uses thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2005-08-30 | — | — | US | disclosed |
| EP-1186604-A1 | BENZAZEPINE DERIVATIVES, PROCESS FOR THE PREPARATION OF THE SAME AND USES THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-03-13 | — | — | EP | disclosed |