Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | PKM | P14618 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSPA5 | P11021 | 3/20 | 0.40 |
| ▸ | HSPA2 | P54652 | 1/20 | 0.40 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7876536 | 0.87 | HDAC6 (0.51) | PKMLMNAL3MBTL1SMN1; SMN2TSHR | |
| SCHEMBL7879190 | 0.77 | PKM (0.54) | ALDH1A1PKMMAPTHTTRAB9A | |
| SCHEMBL4119851 | 0.72 | HSPA5 (0.57) | MAPTMEN1KMT2ALMNATSHR | |
| SCHEMBL6056907 | 0.72 | HSPA5 (0.57) | MAPTMEN1KMT2ALMNATSHR | |
| SCHEMBL7421285 | 0.72 | HDAC6 (0.47) | PKMMAPTL3MBTL1SMN1; SMN2MAPK1 | |
| SCHEMBL8366793 | 0.72 | PKM (0.74) | ALDH1A1PKMMAPTHTTRAB9A | |
| SCHEMBL7873389 | 0.71 | HSPA5 (0.53) | MAPTMEN1KMT2ALMNATSHR | |
| Hydrochloric Acid SCHEMBL7422746 | 0.71 | HSPA5 (0.56) | MAPTMEN1KMT2ALMNATSHR | |
| SCHEMBL11221591 | 0.66 | PKM (1.00) | ALDH1A1PKMMAPTHTTRAB9A | |
| SCHEMBL5875678 | 0.66 | CYP1A2 (0.62) | ALDH1A1PKMLMNAL3MBTL1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6329400-B1 | INHIBITION OR ANTAGONISM OF MATRIX METALLOPROTEASES, AND/OR TUMOR NECROSIS FACTOR-ALPHA; EXTRACELLULAR MATRIX DEGRADATION, INHIBITION OF SHEDDING OF CELL SURFACE PROTEIN ECTODOMAINS AND CD23 PROTEOLYSIS | GLAXO WELLCOME INC. | 2001-12-11 | — | — | US | disclosed |