Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | THRB | P10828 | 2/20 | 0.51 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | YTHDF2 | Q9Y5A9 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 4/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3474190 | 0.93 | SMN1; SMN2 (0.55) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL3469803 | 0.85 | ALDH1A1 (0.49) | SMN1; SMN2ALDH1A1LMNAPKMMEN1 | |
| SCHEMBL3472624 | 0.83 | SMN1; SMN2 (0.48) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL2182131 | 0.78 | SMN1; SMN2 (0.61) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL2182128 | 0.78 | SMN1; SMN2 (0.61) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL3472022 | 0.74 | SMN1; SMN2 (0.57) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL3472928 | 0.74 | SMN1; SMN2 (0.57) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL3474709 | 0.73 | SMN1; SMN2 (0.56) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB | |
| SCHEMBL3474764 | 0.72 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1LMNAPKMMEN1 | |
| SCHEMBL2181477 | 0.72 | KDM4E (0.67) | SMN1; SMN2KDM4EALDH1A1HPGDTHRB |
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-2010072807-A2 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2010-07-01 | — | — | WO | disclosed |
| WO-2010072807-A2 | INHIBITORS OF CYSTATHIONINE BETA SYNTHASE TO REDUCE THE NEUROTOXIC OVERPRODUCTION OF ENDOGENOUS HYDROGEN SULFIDE | FONDATION JEROME LEJEUNE (FR) | 2010-07-01 | — | — | WO | disclosed |