Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 6/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 5/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14941744 | 0.92 | ALDH1A1 (0.55) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14941828 | 0.92 | KDM4E (0.52) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14941546 | 0.91 | ALDH1A1 (0.54) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14950966 | 0.90 | ALDH1A1 (0.64) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14940581 | 0.90 | ALDH1A1 (0.56) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14941540 | 0.89 | ALDH1A1 (0.53) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14941544 | 0.86 | ALDH1A1 (0.51) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14950799 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14940628 | 0.85 | ALDH1A1 (0.61) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 | |
| SCHEMBL14941709 | 0.85 | ALDH1A1 (0.57) | ALDH1A1KDM4EMEN1MAPK1HSD17B10 |
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-2013068592-A1 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2013-05-16 | — | — | WO | disclosed |