Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 17/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 13/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.55 |
| ▸ | KDM1A | O60341 | 1/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | INSR | P06213 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.43 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3137166 | 0.89 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3137176 | 0.89 | HDAC1 (0.69) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3140277 | 0.88 | HDAC1 (0.53) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3140289 | 0.88 | HDAC1 (0.53) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL27704574 | 0.80 | HDAC1 (0.46) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3420879 | 0.80 | HDAC1 (0.66) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3420883 | 0.80 | HDAC1 (0.66) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3141309 | 0.79 | HDAC1 (0.52) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3133896 | 0.78 | HDAC1 (0.41) | HDAC1HDAC2HDAC3HDAC10HDAC11 | |
| SCHEMBL3419142 | 0.78 | HDAC1 (0.53) | HDAC1HDAC2HDAC3HDAC10HDAC11 |
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-3678740-A1 | HDAC INHIBITOR IN COMBINATION WITH IMMUNE CHECKPOINT MODULATOR FOR CANCER THERAPY | 4SC AG (DE) | 2020-07-15 | — | — | EP | disclosed |
| WO-2019048629-A1 | HDAC INHIBITOR IN COMBINATION WITH IMMUNE CHECKPOINT MODULATOR FOR CANCER THERAPY | 4SC AG (DE) | 2019-03-14 | — | — | WO | disclosed |