Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.66 |
| ▸ | MAPT | P10636 | 6/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | HTT | P42858 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | CASP6 | P55212 | 1/20 | 0.51 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.50 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.50 |
| ▸ | METAP1 | P53582 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL366012 | 0.95 | ALDH1A1 (0.62) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Hydrochloric Acid SCHEMBL27777765 | 0.93 | ALDH1A1 (0.60) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Quinoline SCHEMBL28125811 | 0.90 | ALDH1A1 (0.57) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Dinitrophenylene SCHEMBL27728956 | 0.89 | ALDH1A1 (0.58) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| SCHEMBL27680597 | 0.88 | ALDH1A1 (0.54) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Selenium SCHEMBL10539506 | 0.88 | ALDH1A1 (0.54) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| SCHEMBL1012937 | 0.85 | BAZ1A (0.60) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| SCHEMBL30626616 | 0.85 | BAZ1A (0.60) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Quinoline SCHEMBL28214997 | 0.85 | ALDH1A1 (0.61) | ALDH1A1MAPTRAB9AHTTNPC1 | |
| Quinoline SCHEMBL27625328 | 0.84 | MAPT (0.58) | ALDH1A1MAPTRAB9AHTTNPC1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105753838-A | Novel high-regioselectivity amination method of quinoline derivatives | 安阳师范学院 | 2016-07-13 | — | — | CN | claimed |
| CN-106588926-B | A kind of 2,7- diazas [3,2,1] bicyclooctane and its derivative and its synthetic method and application | 华东师范大学 | 2018-10-09 | — | — | CN | disclosed |
| CN-106588926-A | 2,7-diaza[3,2,1]bicycloocatane and derivative thereof and synthesis method and application of 2,7-diaza[3,2,1]bicycloocatane and derivative thereof | 华东师范大学 | 2017-04-26 | — | — | CN | disclosed |
| EP-0527186-A4 | — | UNIV ILLINOIS (US) | 1995-01-18 | — | — | EP | disclosed |
| EP-0527186-A1 | PHOTODYNAMIC PLANT DEFOLIANTS AND CHLOROPHYLL BIOSYNTHESIS MODULATORS | The Board of Trustees for the University of Illinois (US) | 1993-02-17 | — | — | EP | disclosed |
| WO-1991016820-A1 | PHOTODYNAMIC PLANT DEFOLIANTS AND CHLOROPHYLL BIOSYNTHESIS MODULATORS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 1991-11-14 | — | — | WO | disclosed |