Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 11/20 | 0.45 |
| ▸ | RARB | P10826 | 3/20 | 0.44 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | CCR2 | P41597 | 2/20 | 0.43 |
| ▸ | CCR7 | P32248 | 1/20 | 0.43 |
| ▸ | CCR3 | P51677 | 1/20 | 0.41 |
| ▸ | CCR4 | P51679 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3458669 | 0.95 | CCR5 (0.49) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL3458663 | 0.95 | CCR5 (0.49) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6351904 | 0.93 | CCR5 (0.39) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6342973 | 0.92 | CCR5 (0.38) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6349873 | 0.92 | ERN1 (0.39) | CCR5CCR2CCR7ALPLPLA2G2A | |
| SCHEMBL5657701 | 0.91 | RARB (0.50) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL6351503 | 0.88 | ALDH1A1 (0.43) | CCR5ABCB1 | |
| SCHEMBL6341329 | 0.86 | CCR5 (0.38) | CCR5CCR2CCR7CCR3CCR4 | |
| SCHEMBL3459334 | 0.86 | RARB (0.51) | CCR5RARBRARACCR2CCR7 | |
| SCHEMBL3459331 | 0.86 | RARB (0.51) | 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 |