Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | CD4 | P01730 | 1/20 | 0.38 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | CCR4 | P51679 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7594219 | 0.88 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1KDM4EHTR2AHTR6 | |
| SCHEMBL7594215 | 0.82 | SMN1; SMN2 (0.47) | SMN1; SMN2ALDH1A1HTR2ALMNATSHR | |
| SCHEMBL7865669 | 0.80 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1KDM4EHTR2AHTR6 | |
| SCHEMBL4710254 | 0.78 | BACE1 (0.41) | LMNAACHE | |
| SCHEMBL7598488 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1HTR2AHTR6DRD2 | |
| SCHEMBL7598485 | 0.76 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1HTR2AHTR6DRD2 | |
| SCHEMBL9383745 | 0.75 | ITK (0.45) | DRD2LMNADRD4ACHE | |
| SCHEMBL9387794 | 0.74 | ALDH1A1 (0.45) | SMN1; SMN2ALDH1A1KDM4EHTR2AHTR6 | |
| SCHEMBL7598492 | 0.74 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1HTR2AHTR6LMNA | |
| SCHEMBL251631 | 0.74 | ACHE (0.53) | SMN1; SMN2DRD2DRD4ACHE |
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-1853590-A1 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS SIRTUIN MODULATORS | Sirtris Pharmaceuticals, Inc. (US) | 2007-11-14 | — | — | EP | disclosed |
| WO-2006094235-A1 | FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2006-09-08 | — | — | WO | disclosed |