Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 3/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.33 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.33 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.33 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.33 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.33 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.33 |
| ▸ | TUBB8 | Q3ZCM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL19636934 | 0.90 | ERBB2 (0.41) | ERBB2HDAC1HDAC8HDAC2HDAC6 | |
| SCHEMBL19636845 | 0.89 | ERBB2 (0.40) | ERBB2HDAC1HDAC8HDAC2HDAC6 | |
| SCHEMBL19633223 | 0.85 | NAMPT (0.43) | HDAC1HDAC6MAPTTDP1NPSR1 | |
| SCHEMBL30944502 | 0.79 | NAMPT (0.42) | MAPTNAMPTKDM4EDRD2MAPK14 | |
| SCHEMBL30944532 | 0.79 | NAMPT (0.42) | MAPTNAMPTKDM4EDRD2MAPK14 | |
| SCHEMBL19636936 | 0.77 | ERBB2 (0.40) | ERBB2HDAC1HDAC8HDAC2MAPT | |
| SCHEMBL19633220 | 0.76 | ERBB2 (0.40) | ERBB2HDAC1HDAC8HDAC2MAPT | |
| SCHEMBL19633089 | 0.75 | ERBB2 (0.43) | ERBB2HDAC1HDAC8HDAC2 | |
| SCHEMBL30046311 | 0.75 | SMN1; SMN2 (0.37) | ERBB2HDAC1HDAC8HDAC2MAPT | |
| SCHEMBL19637500 | 0.74 | ERBB2 (0.43) | ERBB2HDAC1HDAC8HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3458069-B1 | PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF | MERSANA THERAPEUTICS INC (US) | 2023-07-05 | — | — | EP | disclosed |