Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 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 | |
|---|---|---|---|---|
| SCHEMBL9052356 | 0.84 | BCHE (0.50) | ALDH1A1MAPTPKMKDM4EMEN1 | |
| SCHEMBL9054166 | 0.79 | BCHE (0.49) | ALDH1A1MAPTPKMKDM4EMEN1 | |
| SCHEMBL7848521 | 0.77 | HTR1A (0.44) | ALDH1A1KDM4EMEN1KMT2AHTR1A | |
| Hydrochloric Acid SCHEMBL7858339 | 0.76 | HTR1A (0.45) | ALDH1A1KDM4EMEN1KMT2AHTR1A | |
| SCHEMBL8916149 | 0.74 | NOS3 (0.50) | ALDH1A1MAPTPKMKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL7840137 | 0.72 | HTR1A (0.48) | ALDH1A1KDM4EMEN1KMT2AHTR1A | |
| SCHEMBL8914916 | 0.71 | RAB9A (0.49) | ALDH1A1KDM4EHTR1ADRD2HTR7 | |
| SCHEMBL8923805 | 0.70 | CYP2C9 (0.59) | ALDH1A1MAPTKDM4EMEN1KMT2A | |
| SCHEMBL7848625 | 0.70 | NOS3 (0.42) | MAPTRAB9ANPC1SMN1; SMN2CYP1A2 | |
| SCHEMBL9052994 | 0.69 | MAPT (0.60) | ALDH1A1MAPTPKMKDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996000224-A1 | 4-S- AND N-SUBSTITUTED 6-ALKYLPYRIDINES FOR CONTROLLING HELICOBACTER BACTERIA | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1996-01-04 | — | — | WO | disclosed |