Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 3/20 | 0.48 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.44 |
| ▸ | KCNAB1 | Q14722 | 1/20 | 0.44 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TMPRSS2 | O15393 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1187044 | 0.91 | ESR2 (0.55) | ESR2RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1188540 | 0.88 | ESR2 (0.62) | ESR2RAB9ANPC1KMT2ASMN1; SMN2 | |
| SCHEMBL1187860 | 0.88 | ESR2 (0.62) | ESR2RAB9ANPC1KMT2ASMN1; SMN2 | |
| SCHEMBL1188104 | 0.87 | ESR2 (0.61) | ESR2RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1188499 | 0.87 | ESR2 (0.61) | ESR2RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1188421 | 0.86 | ESR2 (0.60) | ESR2RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1188497 | 0.86 | ESR2 (0.60) | ESR2RAB9AMAPTNPC1SMN1; SMN2 | |
| SCHEMBL1188616 | 0.85 | ESR2 (0.58) | ESR2RAB9AMAPTNPC1KMT2A | |
| SCHEMBL1187947 | 0.85 | ESR2 (0.58) | ESR2RAB9AMAPTNPC1PIK3CA | |
| SCHEMBL1187768 | 0.85 | ESR2 (0.53) | ESR2RAB9AMAPTNPC1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8735425-B2 | Tetrahydroisoquinoline derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2014-05-27 | — | — | US | disclosed |
| EP-2256105-B1 | NOVEL TETRAHYDROISOQUINOLINE DERIVATIVE | DAIICHI SANKYO CO LTD (JP) | 2013-12-04 | — | — | EP | disclosed |
| EP-2256105-A1 | NOVEL TETRAHYDROISOQUINOLINE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2010-12-01 | — | — | EP | disclosed |