Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | NEK2 | P51955 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8602787 | 0.76 | MAPT (0.55) | GAAMAPTALDH1A1POLBRXFP1 | |
| SCHEMBL29082200 | 0.73 | KDM4E (0.50) | GAAKDM4EMAPTCA2MCL1 | |
| SCHEMBL8601952 | 0.71 | ALDH1A1 (0.38) | GAAMAPTALDH1A1POLBRXFP1 | |
| SCHEMBL8603311 | 0.71 | HTR2A (0.46) | GAAKDM4EMAPTDYRK1AALDH1A1 | |
| SCHEMBL8808071 | 0.68 | KDM4E (0.52) | KDM4EALDH1A1CA2TSHRMEN1 | |
| SCHEMBL8600076 | 0.68 | ADRB3 (0.37) | GAAMAPTALDH1A1POLBRXFP1 | |
| SCHEMBL8600228 | 0.67 | ALDH1A1 (0.32) | MAPTALDH1A1L3MBTL1 | |
| SCHEMBL8720110 | 0.66 | CHEK1 (0.65) | GAAKDM4EMAPTCHEK1NEK2 | |
| SCHEMBL827004 | 0.66 | AHR (0.50) | GAAKDM4EMAPTCHEK1NEK2 | |
| SCHEMBL8604489 | 0.66 | ALDH1A1 (0.53) | KDM4EMAPTDYRK1AALDH1A1POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-5773449-A | BACTERICIDES FOR HELICOBACTER | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0786454-A1 | THIOQUINOLONE DERIVATIVE | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1997-07-30 | — | — | EP | disclosed |