Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FEN1 | P39748 | 1/20 | 0.43 |
| ▸ | GPR17 | Q13304 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | IDH1 | O75874 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | HNF4A | P41235 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8603411 | 0.78 | RHEB (0.42) | MEN1KMT2AALDH1A1 | |
| SCHEMBL7504545 | 0.76 | BACE1 (0.48) | MEN1KMT2AIDH1CALM1CYP2D6 | |
| SCHEMBL8600722 | 0.76 | MAOA (0.43) | MEN1KMT2ACYP3A4 | |
| SCHEMBL8602858 | 0.76 | IMPDH2 (0.56) | GABRA1ALDH1A1HPGDGABRA3 | |
| SCHEMBL8600219 | 0.75 | MAOA (0.43) | MEN1KMT2AALDH1A1 | |
| SCHEMBL8602871 | 0.75 | NPC1 (0.53) | FEN1GPR17MEN1KMT2AGSK3B | |
| SCHEMBL8603563 | 0.74 | PARP1 (0.39) | MEN1KMT2ACYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30030142 | 0.73 | CYP17A1 (0.55) | CYP2D6 | |
| SCHEMBL8604113 | 0.73 | CYP17A1 (0.55) | CYP2D6 | |
| SCHEMBL8603453 | 0.71 | RELA (0.41) | CYP1A2 |
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 |