Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 4/20 | 0.43 |
| ▸ | DRD3 | P35462 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | PTAFR | P25105 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14307767 | 0.89 | ALDH1A1 (0.51) | ALDH1A1SMN1; SMN2MAPTRAB9AKDM4E | |
| SCHEMBL11601198 | 0.88 | KCNH2 (0.49) | ALDH1A1SMN1; SMN2MAPTRAB9ANPC1 | |
| SCHEMBL11601728 | 0.87 | KCNH2 (0.53) | MAPTRAB9ANPC1KCNH2DRD2 | |
| SCHEMBL11600950 | 0.87 | KCNH2 (0.46) | KCNH2DRD2DRD3HTR2AHRH1 | |
| SCHEMBL11601081 | 0.83 | FNTA (0.43) | DRD2DRD3HTR2AHRH1HTR1A | |
| SCHEMBL11600176 | 0.82 | SETD7 (0.48) | SMN1; SMN2KCNH2HTR1APTAFRFNTA | |
| SCHEMBL14318737 | 0.81 | KCNH2 (0.67) | ALDH1A1SMN1; SMN2MAPTRAB9AKDM4E | |
| SCHEMBL11601639 | 0.81 | PTAFR (0.50) | SMN1; SMN2MAPTDRD2DRD3HTR2A | |
| SCHEMBL11600344 | 0.81 | KCNH2 (0.55) | ALDH1A1MAPTRAB9ANPC1TDP1 | |
| SCHEMBL11599673 | 0.80 | PTAFR (0.60) | MAPTKCNH2DRD2DRD3HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| US-4072756-A | Tricyclo piperidino ketones and soporific compositions thereof | SANDOZ LTD. (CH) | 1978-02-07 | — | — | US | disclosed |