Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 12/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 8/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | HTT | P42858 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL7551884 | 0.93 | HDAC6 (0.44) | HDAC6HDAC1HDAC8KDM4EHTT | |
| SCHEMBL7613735 | 0.90 | HDAC6 (0.44) | HDAC6HDAC1HDAC8ALOX5CYP2C9 | |
| SCHEMBL7607138 | 0.89 | HDAC1 (0.37) | HDAC6HDAC1HDAC8SMN1; SMN2ALOX5 | |
| SCHEMBL7606207 | 0.89 | HDAC1 (0.39) | HDAC6HDAC1HDAC8SMN1; SMN2ALOX5 | |
| SCHEMBL7611332 | 0.89 | HDAC6 (0.44) | HDAC6HDAC1HDAC8KDM4EHTT | |
| SCHEMBL7606176 | 0.87 | HDAC6 (0.44) | HDAC6HDAC1HDAC8KDM4EHTT | |
| SCHEMBL7613468 | 0.84 | HDAC6 (0.42) | HDAC6HDAC1HDAC8KDM4EHTT | |
| SCHEMBL7606062 | 0.83 | HDAC6 (0.45) | HDAC6HDAC1HDAC8HTTKMT2A | |
| SCHEMBL7607178 | 0.82 | PKM (0.36) | HDAC6HDAC1HDAC8KMT2AMEN1 | |
| SCHEMBL7612615 | 0.79 | MAPT (0.41) | HDAC6HDAC1ALDH1A1LMNACYP1A2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1263728-A2 | PDE IV INHIBITING AMIDES, COMPOSITIONS AND PHARMACEUTICAL USE | MERCK FROSST CANADA INC. (CA) | 2002-12-11 | — | — | EP | claimed |
| US-6436965-B1 | INHIBITION OF PHOSPHODIESTERASE; 3-CARBOCYCLIC(ALKYL)OXY-2-ARYL(ALKYL)AMINOCARBONYL-1-ARYL(ALKYL)INDOLE OR AZAINDOLE DERIVATIVES | MERCK FROSST CANADA & CO. (CA) | 2002-08-20 | — | — | US | claimed |
| WO-2001064639-A2 | PDE IV INHIBITING AMIDES, COMPOSITIONS AND PHARMACEUTICAL USE | MERCK FROSST CANADA & CO. (CA) | 2001-09-07 | — | — | WO | claimed |
| US-6436965-B1 | INHIBITION OF PHOSPHODIESTERASE; 3-CARBOCYCLIC(ALKYL)OXY-2-ARYL(ALKYL)AMINOCARBONYL-1-ARYL(ALKYL)INDOLE OR AZAINDOLE DERIVATIVES | MERCK FROSST CANADA & CO. (CA) | 2002-08-20 | — | — | US | disclosed |