Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.63 |
| ▸ | MEN1 | O00255 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL14941553 | 0.93 | ALDH1A1 (0.63) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14941614 | 0.91 | ALDH1A1 (0.61) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14950947 | 0.90 | MEN1 (0.70) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14950838 | 0.90 | MEN1 (0.70) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14941557 | 0.90 | ALDH1A1 (0.63) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14941724 | 0.88 | ALDH1A1 (0.59) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14950867 | 0.86 | ALDH1A1 (0.57) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14940673 | 0.86 | MEN1 (0.54) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14941598 | 0.85 | MEN1 (0.58) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 | |
| SCHEMBL14940577 | 0.83 | MEN1 (0.60) | ALDH1A1MEN1KDM4EMAPK1HSD17B10 |
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-2013068592-A1 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2013-05-16 | — | — | WO | claimed |
| 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 |