Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.34 |
| ▸ | PLAU | P00749 | 4/20 | 0.33 |
| ▸ | HPN | P05981 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL20788693 | 0.89 | NPC1 (0.39) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20787628 | 0.87 | MEN1 (0.41) | HDAC8HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL20787469 | 0.83 | PLAU (0.40) | PLAUHPNLMNAGAAMEN1 | |
| SCHEMBL20764600 | 0.81 | CACNA1B (0.37) | HDAC3HDAC1HDAC2PLAUTP53 | |
| SCHEMBL20764599 | 0.81 | CACNA1B (0.37) | HDAC3HDAC1HDAC2PLAUTP53 | |
| SCHEMBL20764481 | 0.80 | MEN1 (0.44) | HDAC8HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL22076698 | 0.80 | MMP2 (0.38) | HDAC3HDAC1HDAC2PLAUTP53 | |
| SCHEMBL20764482 | 0.80 | MEN1 (0.44) | HDAC8HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL22076696 | 0.80 | MMP2 (0.38) | HDAC3HDAC1HDAC2PLAUTP53 | |
| SCHEMBL20764473 | 0.80 | MEN1 (0.37) | HDAC3HDAC1HDAC2PLAUTP53 |
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-2019038405-A1 | NOVEL CYSTOBACTAMIDE DERIVATIVES | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2019-02-28 | — | — | WO | disclosed |