Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | PLG | P00747 | 1/20 | 0.47 |
| ▸ | MMP2 | P08253 | 2/20 | 0.46 |
| ▸ | MMP9 | P14780 | 2/20 | 0.46 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.46 |
| ▸ | EHMT2 | Q96KQ7 | 2/20 | 0.45 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.41 |
| ▸ | TLR2 | O60603 | 1/20 | 0.41 |
| ▸ | MMP1 | P03956 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL23976663 | 0.81 | MEN1 (0.48) | MMP2MMP9EHMT2MMP3MMP1 | |
| SCHEMBL20864042 | 0.81 | LTA4H (0.40) | LTA4HPLGCALCRLCA1CA2 | |
| SCHEMBL13820164 | 0.81 | LTA4H (0.70) | LTA4HMMP2MMP9HDAC2POLB | |
| Hydrochloric Acid SCHEMBL14230868 | 0.80 | LTA4H (0.68) | LTA4HMMP2MMP9HDAC2HDAC8 | |
| SCHEMBL24833252 | 0.77 | EPHX1 (0.53) | — | |
| SCHEMBL27793253 | 0.76 | LTA4H (0.48) | LTA4HMMP2SIRT1TLR2 | |
| Acetophenone SCHEMBL27834296 | 0.76 | MMP2 (0.47) | MMP2MMP9CA1CA2TLR2 | |
| SCHEMBL30717893 | 0.76 | GNPAT (0.56) | MMP2 | |
| SCHEMBL1168511 | 0.75 | GSR (0.53) | MMP2MMP9CA1CA2 | |
| SCHEMBL1168516 | 0.75 | GSR (0.53) | MMP2MMP9CA1CA2 |
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-2018094335-A1 | FINE-TUNE MODULATORS OF NEURONAL EXCITABILITY FOR NEUROPSYCHIATRIC DISORDERS | THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) | 2018-05-24 | — | — | WO | disclosed |