Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL11800188 | 0.86 | CYP3A4 (0.41) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL6428738 | 0.84 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL712601 | 0.81 | SMN1; SMN2 (0.33) | CYP2C19PLA2G2ASMN1; SMN2LMNAALDH1A1 | |
| SCHEMBL7674937 | 0.79 | CYP2C9 (0.41) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL25669502 | 0.79 | ALDH1A1 (0.38) | CYP3A4CYP2C9CYP2C19GAAPLA2G2A | |
| Hydrochloric Acid SCHEMBL3018965 | 0.76 | CYP3A4 (0.42) | CYP3A4CYP2C9CYP2C19GAAPLA2G2A | |
| SCHEMBL11805263 | 0.76 | CYP3A4 (0.36) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL11795304 | 0.76 | CYP2C9 (0.41) | CYP3A4CYP2C9CYP2C19GAASMN1; SMN2 | |
| SCHEMBL12903898 | 0.75 | MMP1 (0.37) | PLA2G2ASMN1; SMN2ALDH1A1CA12CA1 | |
| SCHEMBL6829840 | 0.74 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19GAAPLA2G2A |
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-5331001-A | ω-[2-(tetrazolylalkyl)cyclohexyl]-2-aminoalkanoic acids as antagonists of excitatory amino acid receptors | GUILFORD PHARMACEUTICALS INC. (US) | 1994-07-19 | — | — | US | disclosed |