Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 2/20 | 0.64 |
| ▸ | BIRC2 | Q13490 | 2/20 | 0.64 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.49 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.44 |
| ▸ | NPC1L1 | Q9UHC9 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 5/20 | 0.41 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20954995 | 0.89 | XIAP (0.52) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL2800892 | 0.89 | HDAC1 (0.56) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL20954809 | 0.87 | HDAC1 (0.51) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL30701483 | 0.85 | XIAP (0.72) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL8221795 | 0.85 | HDAC1 (0.56) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL21989231 | 0.85 | XIAP (0.48) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL15676881 | 0.84 | HDAC1 (0.47) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL20955233 | 0.84 | SCN5A (0.52) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL20955202 | 0.84 | XIAP (0.46) | XIAPBIRC2HDAC1HDAC8HDAC6 | |
| SCHEMBL20955118 | 0.83 | HDAC1 (0.47) | XIAPBIRC2HDAC1HDAC8HDAC6 |
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-3480198-B1 | NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | RIKEN (JP) | 2021-05-05 | — | — | EP | disclosed |
| EP-3480198-A1 | NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | RIKEN (JP) | 2019-05-08 | — | — | EP | disclosed |