Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CCR6 | P51684 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CTPS1 | P17812 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL13495888 | 0.86 | LMNA (0.50) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL11507421 | 0.86 | HTT (0.56) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL14206650 | 0.82 | HTT (0.52) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL14335038 | 0.81 | HTT (0.51) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL10373056 | 0.79 | KMT2A (0.58) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL3435490 | 0.79 | CTSB (0.52) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL23536375 | 0.77 | KMT2A (0.59) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL29932132 | 0.77 | KMT2A (0.59) | HTTKMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL7843992 | 0.76 | PDCD1 (0.42) | KMT2AALDH1A1GRM5KDM1AMAOA | |
| SCHEMBL14377179 | 0.76 | HTT (0.58) | HTTKMT2ALMNAMAPTALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6143750-A | NITROGEN HETEROCYCLIC COMPOUNDS AS ENZYME INHIBITORS, FOR PROSTATE PROBLEMS AND MUSCLE RELAXANTS | MERCK & CO., INC. (US) | 2000-11-07 | — | — | US | disclosed |