Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9017859 | 1.00 | HTT (0.37) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| SCHEMBL9017861 | 1.00 | HTT (0.37) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| SCHEMBL9017848 | 1.00 | HTT (0.37) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| SCHEMBL9017919 | 0.98 | POLB (0.35) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| SCHEMBL9017912 | 0.98 | POLB (0.35) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| Hydrochloric Acid SCHEMBL9680977 | 0.97 | POLB (0.35) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| Dimethylcarbate SCHEMBL9679397 | 0.89 | HTT (0.34) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| Dimethylcarbate SCHEMBL9681079 | 0.89 | HTT (0.34) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| Dimethylcarbate SCHEMBL9679403 | 0.89 | HTT (0.34) | HTTSMN1; SMN2CYP2C19CYP1A2POLB | |
| Dimethylcarbate SCHEMBL9681075 | 0.89 | HTT (0.34) | HTTSMN1; SMN2CYP2C19CYP1A2POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0477903-B1 | Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments | HOECHST ROUSSEL PHARMA (US) | 1996-04-03 | — | — | EP | disclosed |
| EP-0477903-A2 | Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1992-04-01 | — | — | EP | disclosed |