Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.35 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CHKA | P35790 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 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 | |
|---|---|---|---|---|
| SCHEMBL5112831 | 0.84 | KMT2A (0.45) | KMT2AHTTMEN1MCL1 | |
| SCHEMBL1820781 | 0.79 | CA2 (0.34) | KMT2AMEN1SIGMAR1CHRM5CHRM3 | |
| SCHEMBL4744923 | 0.78 | HTT (0.55) | KMT2AHTTMEN1 | |
| Methylpiperazine SCHEMBL27627001 | 0.74 | KMT2A (0.40) | KMT2AOPRD1HTTMEN1SIGMAR1 | |
| SCHEMBL962662 | 0.72 | KMT2A (0.75) | KMT2AOPRD1HTTSIGMAR1CA2 | |
| SCHEMBL1706425 | 0.71 | CA2 (0.38) | KMT2AOPRD1MEN1SIGMAR1CHRM5 | |
| Hydrochloric Acid SCHEMBL3852849 | 0.71 | KMT2A (0.72) | KMT2AOPRD1HTTMEN1SIGMAR1 | |
| SCHEMBL3600027 | 0.71 | MEN1 (0.39) | KMT2AOPRD1HTTMEN1SIGMAR1 | |
| SCHEMBL3590883 | 0.70 | HCAR2 (0.38) | KMT2AHTTMEN1SIGMAR1CA2 | |
| SCHEMBL4523072 | 0.68 | CHRM5 (0.39) | KMT2AOPRD1MEN1SIGMAR1CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1963331-A1 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | Exelixis, Inc. (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007070796-A1 | AZEPINOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS | EXELIXIS, INC. (US) | 2007-06-21 | — | — | WO | disclosed |