Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.57 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.55 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | HTR1B | P28222 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Diphenylether SCHEMBL10632533 | 0.93 | LTA4H (0.57) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL10571938 | 0.91 | KCNH2 (0.50) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL1790840 | 0.90 | KCNH2 (0.53) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL3982634 | 0.89 | TAAR1 (0.50) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL4521402 | 0.89 | KCNH2 (0.49) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL5658625 | 0.89 | ALDH1A1 (0.50) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL14085300 | 0.89 | KCNH2 (0.53) | KCNH2KCNA3TAAR1ALDH1A1CA12 | |
| SCHEMBL7501197 | 0.89 | KCNH2 (0.49) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL3683548 | 0.85 | KCNH2 (0.50) | KCNH2KCNA3TAAR1ALDH1A1RECQL | |
| SCHEMBL1618118 | 0.85 | KCNH2 (0.50) | KCNH2KCNA3TAAR1ALDH1A1RECQL |
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 |
|---|---|---|---|---|---|---|---|
| CN-105218426-A | A kind of method of Synthesis of Indole and isoquinilone derivatives | LANZHOU CHEM PHYS INST | 2016-01-06 | — | — | CN | disclosed |
| CN-104177357-A | Isoquinoline salt synthesis method | LANZHOU CHEM PHYS INST | 2014-12-03 | — | — | CN | disclosed |
| US-4985393-A | Bis/hydroxyphenylthio/ Compounds | KANZAKI PAPER MANUFACTURING CO., LTD. (JP) | 1991-01-15 | — | — | US | disclosed |