Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | DPP4 | P27487 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | MMP13 | P45452 | 2/20 | 0.33 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP7 | P09237 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL28628583 | 1.00 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2CTSLCTSBCTSK | |
| SCHEMBL385712 | 0.78 | L3MBTL1 (0.36) | ALDH1A1SMN1; SMN2HTTGAAL3MBTL1 | |
| SCHEMBL385711 | 0.78 | L3MBTL1 (0.36) | ALDH1A1SMN1; SMN2HTTGAAL3MBTL1 | |
| SCHEMBL383047 | 0.77 | L3MBTL1 (0.39) | ALDH1A1HTTLMNAGAAL3MBTL1 | |
| SCHEMBL383046 | 0.77 | L3MBTL1 (0.39) | ALDH1A1HTTLMNAGAAL3MBTL1 | |
| Alanine SCHEMBL4954723 | 0.72 | LTA4H (0.35) | HTTL3MBTL1DPP4RAB9A | |
| SCHEMBL31506885 | 0.71 | HTT (0.38) | ALDH1A1SMN1; SMN2HTTLMNAGAA | |
| SCHEMBL7339055 | 0.71 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HTTGAANPSR1 | |
| SCHEMBL7339063 | 0.71 | SMN1; SMN2 (0.45) | ALDH1A1SMN1; SMN2HTTGAANPSR1 | |
| SCHEMBL676508 | 0.70 | L3MBTL1 (0.35) | ALDH1A1GAAL3MBTL1MMP2MMP1 |
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-2010011325-A2 | SYNTHESIS AND UTILIZATION OF SMALL MOLECULES FOR THE TREATMENT OF INFLAMMATION ASSOCIATED WITH INTERLEUKIN-1 SIGNALING | THE SCRIPPS RESEARCH INSTITUTE (US) | 2010-01-28 | — | — | WO | disclosed |