Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 10/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 4/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | CCR2 | P41597 | 2/20 | 0.31 |
| ▸ | CCR7 | P32248 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.30 |
| ▸ | CCR3 | P51677 | 1/20 | 0.30 |
| ▸ | CCR4 | P51679 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6351901 | 0.91 | CCR5 (0.33) | CCR5CCR2CCR7HRH3 | |
| SCHEMBL6349873 | 0.90 | ERN1 (0.39) | CCR5MAPTALDH1A1HPGDCCR2 | |
| SCHEMBL6351503 | 0.88 | ALDH1A1 (0.43) | CCR5MAPTALDH1A1HPGDKDM4E | |
| SCHEMBL6351904 | 0.87 | CCR5 (0.39) | CCR5MAPTALDH1A1HPGDCCR2 | |
| SCHEMBL6341329 | 0.86 | CCR5 (0.38) | CCR5MAPTHPGDCCR2CCR7 | |
| SCHEMBL6342973 | 0.86 | CCR5 (0.38) | CCR5MAPTALDH1A1HPGDCCR2 | |
| SCHEMBL6350067 | 0.85 | CCR5 (0.45) | CCR5CCR2CCR7ALPLCCR3 | |
| SCHEMBL6342839 | 0.84 | MEN1 (0.39) | CCR5MAPTALDH1A1CCR2KDM4E | |
| SCHEMBL6338733 | 0.82 | NR1H2 (0.36) | CCR5MAPTALDH1A1HPGDGAA | |
| SCHEMBL3458663 | 0.80 | CCR5 (0.49) | CCR5MAPTCCR2CCR7ALPL |
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 |