Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.40 |
| ▸ | F12 | P00748 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2095767 | 0.72 | KDM4E (0.59) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL2092784 | 0.70 | SMN1; SMN2 (0.59) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL13620481 | 0.70 | SMN1; SMN2 (0.53) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL26227380 | 0.69 | MAPT (0.51) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL21689794 | 0.69 | LMNA (0.44) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL12204509 | 0.69 | KCNMA1 (0.47) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL12204504 | 0.69 | SLC9A1 (0.54) | TSHRSMN1; SMN2KCNMA1 | |
| SCHEMBL20627141 | 0.68 | TSHR (0.47) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL28678482 | 0.66 | HDAC3 (0.55) | NPSR1KDM4ETSHRLMNARECQL | |
| SCHEMBL2089555 | 0.66 | KCNMA1 (0.50) | NPSR1KDM4ETSHRLMNARECQL |
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-2719689-B1 | Novel method for synthesising 3-(2-bromo-4,5-dimethoxyphenyl) propanenitrile and use for synthesising ivabradine and the added salts thereof with a pharmaceutically acceptable acid | SERVIER LAB (FR) | 2015-12-23 | — | — | EP | disclosed |