Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | DDIT3 | P35638 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30006076 | 1.00 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| Hydrochloric Acid SCHEMBL30005544 | 0.86 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| Hydrochloric Acid SCHEMBL30005889 | 0.85 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| SCHEMBL30006759 | 0.84 | ALDH1A1 (0.57) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| SCHEMBL30005763 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| SCHEMBL30005626 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| SCHEMBL30005901 | 0.81 | ALDH1A1 (0.63) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| Hydrochloric Acid SCHEMBL30005683 | 0.81 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| Hydrochloric Acid SCHEMBL30006764 | 0.80 | ALDH1A1 (0.56) | ALDH1A1KMT2AMEN1NPSR1RAB9A | |
| SCHEMBL30005769 | 0.80 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1NPSR1RAB9A |
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-2022220725-A1 | LPXH INHIBITORS AS ANTI-INFECTIVE AGENTS | ZAMARATSKI EDOUARD (SE) | 2022-10-20 | — | — | WO | disclosed |