Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | CFD | P00746 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17038770 | 0.91 | TUBB4A (0.46) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL21036099 | 0.90 | POLB (0.48) | TP53MEN1ALDH1A1KMT2AMAPT | |
| SCHEMBL23188087 | 0.87 | HTR6 (0.42) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL21036909 | 0.87 | HTT (0.48) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL23188054 | 0.82 | HSD17B13 (0.39) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL17195550 | 0.81 | HDAC6 (0.62) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL17195548 | 0.80 | HDAC6 (0.58) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL17195553 | 0.78 | HDAC1 (0.53) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL17195588 | 0.77 | NPC1 (0.52) | HDAC1HDAC6HDAC2HDAC8HDAC9 | |
| SCHEMBL17195543 | 0.77 | RAB9A (0.52) | HDAC1HDAC6HDAC2HDAC8HDAC9 |
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-2019104067-A1 | CO-THERAPIES INCLUDING A METASTASIS INHIBITOR | CORNELL UNIVERSITY (US) | 2019-05-31 | — | — | WO | disclosed |