Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19984699 | 0.97 | ALDH1A1 (0.47) | ALDH1A1AAK1SMN1; SMN2HTTCASP3 | |
| SCHEMBL19984569 | 0.86 | AAK1 (0.38) | ALDH1A1AAK1SMN1; SMN2MAPTHTT | |
| SCHEMBL19984522 | 0.82 | ALDH1A1 (0.38) | ALDH1A1AAK1SMN1; SMN2MAPTKMT2A | |
| SCHEMBL19984536 | 0.80 | ALDH1A1 (0.45) | ALDH1A1MAPTKMT2ARAB9AKDM4E | |
| SCHEMBL19975403 | 0.75 | HCRTR1 (0.50) | ALDH1A1FKBP1ACASP3 | |
| SCHEMBL19984545 | 0.71 | HCRTR1 (0.53) | ALDH1A1SMN1; SMN2FKBP1ACASP3 | |
| SCHEMBL28305430 | 0.71 | HCRTR1 (0.53) | ALDH1A1SMN1; SMN2FKBP1ACASP3 | |
| SCHEMBL7322642 | 0.69 | LTA4H (0.46) | ALDH1A1SMN1; SMN2FKBP1AMAPTCASP3 | |
| SCHEMBL29349018 | 0.69 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2FKBP1AHTT | |
| SCHEMBL3452265 | 0.68 | ALDH1A1 (0.43) | ALDH1A1FKBP1A |
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-2018053157-A1 | HEPATITIS B CORE PROTEIN MODULATORS | ASSEMBLY BIOSCIENCES, INC. (US) | 2018-03-22 | — | — | WO | disclosed |