Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD2 | O60906 | 2/20 | 0.58 |
| ▸ | PAM | P19021 | 1/20 | 0.56 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.56 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.56 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.53 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | NPY1R | P25929 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | NPY2R | P49146 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.49 |
| ▸ | RXRA | P19793 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29975832 | 0.88 | SMPD2 (0.51) | SMPD2PAMGRIK1GRIK2HDAC8 | |
| SCHEMBL10993947 | 0.82 | SMPD2 (0.52) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL10993939 | 0.82 | SMPD2 (0.52) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL1008357 | 0.80 | SMPD2 (0.50) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL4299337 | 0.80 | SMPD2 (0.50) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL1683792 | 0.79 | SMPD2 (0.54) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL15338325 | 0.79 | SMPD2 (0.54) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL1683795 | 0.79 | SMPD2 (0.54) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL3317971 | 0.79 | RXRA (0.53) | SMPD2GRIK1GRIK2HDAC8HDAC6 | |
| SCHEMBL3317966 | 0.79 | RXRA (0.53) | SMPD2GRIK1GRIK2HDAC8HDAC6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997048279-A1 | AGENTS WITH ANTIFUNGAL ACTIVITY AND METHODS OF USE THEREOF | UNIVERSITY OF ALBERTA (US) | 1997-12-24 | — | — | WO | claimed |
| WO-1997048279-A1 | AGENTS WITH ANTIFUNGAL ACTIVITY AND METHODS OF USE THEREOF | UNIVERSITY OF ALBERTA (US) | 1997-12-24 | — | — | WO | disclosed |