Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 17/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 2/20 | 1.00 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.81 |
| ▸ | TP53 | P04637 | 1/20 | 0.81 |
| ▸ | LMNA | P02545 | 2/20 | 0.79 |
| ▸ | TSHR | P16473 | 4/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.70 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.70 |
| ▸ | USP2 | O75604 | 4/20 | 0.69 |
| ▸ | CASP1 | P29466 | 1/20 | 0.68 |
| ▸ | CASP7 | P55210 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.65 |
| ▸ | HTT | P42858 | 1/20 | 0.65 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL17791583 | 0.87 | ALDH1A1 (0.81) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17786260 | 0.85 | ALDH1A1 (0.75) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17791573 | 0.85 | ALDH1A1 (0.75) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17786253 | 0.84 | ALDH1A1 (1.00) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17791580 | 0.81 | ALDH1A1 (0.72) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17791591 | 0.81 | HSD17B10 (1.00) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17786264 | 0.81 | ALDH1A1 (0.93) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17791575 | 0.81 | ALDH1A1 (0.70) | ALDH1A1KMT2AHSD17B10TP53LMNA | |
| SCHEMBL17207521 | 0.80 | ALDH1A1 (1.00) | ALDH1A1KMT2AHSD17B10TP53TSHR | |
| SCHEMBL17791863 | 0.80 | ALDH1A1 (0.84) | ALDH1A1KMT2AHSD17B10TP53LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016086008-A1 | SMALL MOLECULE ALDEHYDE DEHYDROGENASE INHIBITORS AND METHODS OF USE THEREOF | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2016-06-02 | — | — | WO | disclosed |
| WO-2016086008-A1 | SMALL MOLECULE ALDEHYDE DEHYDROGENASE INHIBITORS AND METHODS OF USE THEREOF | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2016-06-02 | — | — | WO | disclosed |