Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 10/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | USP9X | Q93008 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL18190940 | 0.99 | ALDH3A1 (0.38) | ALDH3A1HTR6KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL18196934 | 0.92 | ALDH3A1 (0.41) | ALDH3A1HTR6KMT2AALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL20530222 | 0.91 | ALDH3A1 (0.40) | ALDH3A1HTR6KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL18196882 | 0.89 | HTR6 (0.39) | HTR6KMT2ASMN1; SMN2 | |
| SCHEMBL18196946 | 0.88 | HTR6 (0.42) | HTR6KMT2AALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL20530218 | 0.88 | HTR6 (0.39) | HTR6KMT2ASMN1; SMN2GAA | |
| SCHEMBL20530181 | 0.87 | ALDH3A1 (0.40) | ALDH3A1HTR6KMT2AALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL20530238 | 0.87 | HTR6 (0.41) | HTR6KMT2AALDH1A1GAA | |
| SCHEMBL18196924 | 0.87 | HTR6 (0.41) | HTR6ALDH1A1CYP3A4LMNA | |
| Hydrochloric Acid SCHEMBL20530241 | 0.86 | HTR6 (0.41) | HTR6ALDH1A1LMNA |
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-2016175555-A2 | NOVEL 4-METHOXY PYRROLE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | DAEWOONG PHARMACEUTICAL CO., LTD. (KR) | 2016-11-03 | — | — | WO | disclosed |