Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.41 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.35 |
| ▸ | GRIA2 | P42262 | 2/20 | 0.35 |
| ▸ | GRIA3 | P42263 | 2/20 | 0.35 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.35 |
| ▸ | GRM6 | O15303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PNMT | P11086 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL159009 | 0.75 | MAPT (0.53) | GRIA1GRIA2GRIA3GRIA4GRM6 | |
| Nitrobenzene SCHEMBL27257265 | 0.74 | HPRT1 (0.47) | HPRT1PNMTALDH1A1KDM4EMEN1 | |
| Nitromethane SCHEMBL28233660 | 0.74 | HPRT1 (0.45) | HPRT1MAPTPNMTALDH1A1MEN1 | |
| Nitric Acid SCHEMBL27829878 | 0.74 | HPRT1 (0.45) | HPRT1MAPTPNMTALDH1A1MEN1 | |
| SCHEMBL30456072 | 0.73 | MAPT (0.51) | GRIA1GRIA2GRIA3GRIA4GRM6 | |
| Water SCHEMBL30261034 | 0.73 | MAPT (0.51) | GRIA1GRIA2GRIA3GRIA4GRM6 | |
| SCHEMBL626564 | 0.73 | MAPT (0.51) | GRIA1GRIA2GRIA3GRIA4GRM6 | |
| SCHEMBL27795577 | 0.73 | PNMT (0.49) | HPRT1MAPTTDP1PNMTALDH1A1 | |
| Water SCHEMBL28388195 | 0.72 | HPRT1 (0.52) | HPRT1MAPTTDP1ALDH1A1CYP1A2 | |
| Water SCHEMBL27524235 | 0.72 | HPRT1 (0.52) | HPRT1MAPTTDP1ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101163481-A | Improved gacyclidine formulations | NEUROSYSTEC CORP (US) | 2008-04-16 | — | — | CN | disclosed |