Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.54 |
| ▸ | KCNA1 | Q09470 | 4/20 | 0.48 |
| ▸ | KCNAB1 | Q14722 | 4/20 | 0.48 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK3 | P52333 | 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 | |
|---|---|---|---|---|
| SCHEMBL3156959 | 0.88 | SMN1; SMN2 (0.54) | ESR2KCNA1KCNAB1LMNAJAK2 | |
| SCHEMBL4789781 | 0.83 | ESR2 (0.66) | ESR2KCNA1KCNAB1NR1H2NPC1 | |
| SCHEMBL2056208 | 0.81 | ESR2 (0.76) | ESR2NR1H2NPC1RAB9ANAMPT | |
| SCHEMBL3142771 | 0.80 | ESR2 (0.53) | ESR2KCNA1KCNAB1NR1H2LMNA | |
| SCHEMBL5600152 | 0.79 | NR1H2 (0.65) | ESR2KCNA1KCNAB1NR1H2NPC1 | |
| SCHEMBL16645111 | 0.79 | ESR2 (0.60) | ESR2KCNA1KCNAB1NR1H2NPC1 | |
| SCHEMBL3155935 | 0.79 | ESR2 (0.54) | ESR2NR1H2NPC1RAB9ANAMPT | |
| SCHEMBL1187860 | 0.79 | ESR2 (0.62) | ESR2KCNA1KCNAB1NR1H2NPC1 | |
| SCHEMBL6393284 | 0.78 | PTPN1 (0.64) | ESR2KCNA1KCNAB1NR1H2NPC1 | |
| SCHEMBL16645108 | 0.78 | ESR2 (0.53) | ESR2KCNA1KCNAB1NR1H2LMNA |
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-2007729-B1 | SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS, THEIR PREPARATION AND USE IN MEDICAMENTS | ESTEVE LABOR DR (ES) | 2012-06-27 | — | — | EP | disclosed |