Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 10/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.35 |
| ▸ | CCR2 | P41597 | 2/20 | 0.35 |
| ▸ | CCR7 | P32248 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 4/20 | 0.34 |
| ▸ | CCR3 | P51677 | 1/20 | 0.34 |
| ▸ | CCR4 | P51679 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 3/20 | 0.32 |
| ▸ | MMP3 | P08254 | 3/20 | 0.32 |
| ▸ | MMP7 | P09237 | 3/20 | 0.32 |
| ▸ | MMP9 | P14780 | 3/20 | 0.32 |
| ▸ | MMP8 | P22894 | 3/20 | 0.32 |
| ▸ | MMP2 | P08253 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6342867 | 0.90 | NR1H2 (0.38) | CCR5NR1H2HDAC1HDAC6GPR119 | |
| SCHEMBL6340943 | 0.89 | CCR5 (0.37) | CCR5NR1H2HDAC1HDAC6GPR119 | |
| SCHEMBL6343620 | 0.88 | GPR119 (0.42) | HDAC1HDAC6GPR119MMP13 | |
| SCHEMBL6338733 | 0.87 | NR1H2 (0.36) | CCR5NR1H2HDAC1HDAC6GPR119 | |
| SCHEMBL6351963 | 0.86 | GPR119 (0.37) | CCR5NR1H2HDAC1HDAC6GPR119 | |
| SCHEMBL6341329 | 0.82 | CCR5 (0.38) | CCR5CCR2CCR7CCR3CCR4 | |
| SCHEMBL6343228 | 0.82 | MEN1 (0.41) | CCR5CCR2CCR7CCR3CCR4 | |
| SCHEMBL6340953 | 0.80 | HDAC1 (0.38) | HDAC1HDAC6GPR119 | |
| SCHEMBL6340987 | 0.78 | GPR119 (0.44) | HDAC1HDAC6GPR119 | |
| SCHEMBL6344215 | 0.78 | HDAC1 (0.36) | HDAC1HDAC6GPR119 |
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 |