Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | MAOB | P27338 | 3/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10599649 | 0.89 | KMT2A (0.58) | KMT2ALMNAALDH1A1SRD5A2 | |
| SCHEMBL190531 | 0.87 | CES2 (0.50) | KMT2ARAB9ANPC1L3MBTL1LMNA | |
| SCHEMBL10492823 | 0.81 | LMNA (0.64) | KMT2AL3MBTL1LMNACASP3SENP7 | |
| SCHEMBL20041199 | 0.79 | KMT2A (0.48) | KMT2ALMNAALDH1A1SRD5A2 | |
| SCHEMBL1106684 | 0.76 | IDO1 (0.58) | KMT2ALMNATAAR1ALDH1A1MEN1 | |
| SCHEMBL19072622 | 0.76 | KMT2A (0.45) | KMT2ALMNAALDH1A1SRD5A2 | |
| SCHEMBL2132508 | 0.76 | CA1 (0.50) | KMT2ARAB9ANPC1L3MBTL1LMNA | |
| SCHEMBL6704209 | 0.75 | THRB (0.44) | KMT2ATAAR1MEN1 | |
| SCHEMBL10389845 | 0.75 | RAB9A (0.53) | KMT2ARAB9ANPC1L3MBTL1TAAR1 | |
| SCHEMBL9065883 | 0.74 | SRD5A2 (0.61) | KMT2ARAB9ANPC1L3MBTL1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2651888-B1 | N-((1H-indol-3-yl)-alkyl)-4-benzyl)benzamide and N-((1H-pyrrolo[2,3-b]pyridin-3-yl)-alkyl)-4-benzyl)benzamide derivatives as alpha synuclein aggregation inhibitors for the treatment of neurodegenerative disorders | UNIV LEUVEN KATH (BE) | 2017-05-17 | — | — | EP | disclosed |