Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 8/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | TOP1 | P11387 | 2/20 | 0.35 |
| ▸ | HRAS | P01112 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4275897 | 0.89 | HDAC1 (0.51) | ERBB2HDAC1HDAC2HDAC8TOP1 | |
| SCHEMBL3984841 | 0.85 | MEN1 (0.43) | TOP1HRASESR1ESR2MEN1 | |
| SCHEMBL3990770 | 0.84 | CSNK2A2 (0.41) | MEN1KMT2ACSNK2A2CSNK2A1KDM4E | |
| SCHEMBL19614861 | 0.82 | ERBB2 (0.41) | ERBB2HDAC1HDAC2HDAC8TOP1 | |
| SCHEMBL14003291 | 0.81 | HDAC1 (0.44) | ERBB2HDAC1HDAC2HDAC8TOP1 | |
| SCHEMBL13845552 | 0.80 | HDAC1 (0.49) | ERBB2HDAC1HDAC2HDAC8TOP1 | |
| SCHEMBL19636845 | 0.80 | ERBB2 (0.40) | ERBB2HDAC1HDAC2HDAC8KDM4E | |
| SCHEMBL19636934 | 0.79 | ERBB2 (0.41) | ERBB2HDAC1HDAC2HDAC8MAPT | |
| SCHEMBL3417386 | 0.77 | ERBB2 (0.43) | ERBB2HDAC1HDAC2HDAC8TOP1 | |
| SCHEMBL14441974 | 0.77 | ERBB2 (0.43) | ERBB2HDAC1HDAC2HDAC8TOP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009060208-A1 | PYRROLOBENZODIAZEPINES | SPIROGEN LIMITED (GB) | 2009-05-14 | — | — | WO | disclosed |