Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
| ▸ | MAP3K7 | O43318 | 3/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7968186 | 0.99 | HDAC3 (0.32) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7964677 | 0.95 | HDAC3 (0.34) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7480416 | 0.95 | ABCB1 (0.34) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7962042 | 0.95 | HDAC3 (0.32) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7955090 | 0.95 | HDAC3 (0.32) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL7963051 | 0.95 | HDAC3 (0.34) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| Hydrochloric Acid SCHEMBL7966589 | 0.94 | HDAC3 (0.32) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7966817 | 0.94 | HDAC3 (0.33) | HDAC3BRD4HDAC4HDAC1HDAC7 | |
| SCHEMBL7966262 | 0.94 | PTGES (0.37) | PTGES | |
| Hydrochloric Acid SCHEMBL7962708 | 0.93 | PTGES (0.37) | PTGES |
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 |
|---|---|---|---|---|---|---|---|
| US-6316482-B1 | FOR THERAPY AND PROPHYLAXIS OF HYPERTENSION, HEART FAILURE, RENAL INSUFFICIENCY, EDEMA, ASCITES, VASOPRESSIN PARASECRETION SYNDROME, HEPATOCIRRHOSIS, HYPONATREMIA, HYPOKALEMIA, DIABETIC, CIRCULATION DISORDER, CEREBROVASCULAR DISEASE | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2001-11-13 | — | — | US | disclosed |