Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LDHA | P00338 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 2/20 | 0.32 |
| ▸ | PPARA | Q07869 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | CTSD | P07339 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2795206 | 1.00 | KMT2A (0.37) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL2794818 | 0.92 | LDHA (0.35) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL3778768 | 0.92 | LDHA (0.35) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL2795622 | 0.92 | MTNR1A (0.36) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL2795983 | 0.90 | CYP3A4 (0.35) | KMT2AALDH1A1LDHASMN1; SMN2MMP1 | |
| SCHEMBL3631848 | 0.90 | CYP3A4 (0.35) | KMT2AALDH1A1LDHASMN1; SMN2MMP1 | |
| SCHEMBL2794676 | 0.89 | KMT2A (0.35) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL2798586 | 0.80 | ALDH1A1 (0.32) | KMT2AALDH1A1LDHASMN1; SMN2LMNA | |
| SCHEMBL3546929 | 0.74 | HCRTR1 (0.40) | KMT2AALDH1A1SMN1; SMN2HTTMEN1 | |
| SCHEMBL28771483 | 0.73 | BCHE (0.54) | KMT2AHTTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2142510-A1 | NOVEL ISOQUINOLINIUM COMPOUNDS USEFUL IN THE PREPARATION OF CISATRACURIUM AND ASSOCIATED INTERMEDIATES | Chemagis Ltd. (IL) | 2010-01-13 | — | — | EP | disclosed |
| WO-2008132746-A1 | NOVEL ISOQUINOLINIUM COMPOUNDS USEFUL IN THE PREPARATION OF CISATRACURIUM AND ASSOCIATED INTERMEDIATES | CHEMAGIS LTD. (IL) | 2008-11-06 | — | — | WO | disclosed |