Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 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 | |
|---|---|---|---|---|
| SCHEMBL28649015 | 0.87 | HDAC1 (0.42) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL134923 | 0.82 | EPHX2 (0.46) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL1639757 | 0.82 | TSHR (0.50) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL14532908 | 0.82 | EPHX2 (0.39) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL3914424 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL2380206 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL3251209 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL20450540 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL14482131 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 | |
| SCHEMBL14482719 | 0.80 | EPHX2 (0.49) | HDAC8HDAC1HDAC2HDAC6HDAC3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101384601-A | Novel 6-amino-morphinan derivatives, method of manufacturing them and their application as analgesics | ALCASYNN PHARMACEUTICALS GMBH (AT) | 2009-03-11 | — | — | CN | claimed |
| CN-109796384-A | Method for continuously and rapidly preparing 2-hydroxy-4-methylthiobutyrate | 禄丰天宝磷化工有限公司 | 2019-05-24 | — | — | CN | disclosed |
| CN-101384601-A | Novel 6-amino-morphinan derivatives, method of manufacturing them and their application as analgesics | ALCASYNN PHARMACEUTICALS GMBH (AT) | 2009-03-11 | — | — | CN | disclosed |
| US-20080220536-A1 | Methods for Identifying Compounds that Modulate Enzymatic Activities by Employing Covalently Bonded Target-Extender Complexes with Ligand Candidates | ERIANSON DANIEL A | 2008-09-11 | — | — | US | disclosed |
| US-7214487-B2 | Methods for identifying compounds that modulate enzymatic activities by employing covalently bonded target-extender complexes with ligand candidates | SUNESIS PHARMACEUTICALS, INC. (US) | 2007-05-08 | — | — | US | disclosed |
| EP-0558673-A1 | RETROVIRAL PROTEASE INHIBITORS. | MONSANTO CO (US) | 1993-09-08 | — | — | EP | disclosed |
| WO-1992008699-A1 | RETROVIRAL PROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1992-05-29 | — | — | WO | disclosed |