Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.44 |
| ▸ | CTSV | O60911 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.41 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.41 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL29046043 | 0.78 | PKM (0.55) | PKMHPGDAKR1C3AKR1C2POLB | |
| SCHEMBL15620720 | 0.77 | PKM (0.47) | PKMHPGDPOLBALDH1A1LMNA | |
| SCHEMBL15620721 | 0.77 | PKM (0.47) | PKMHPGDPOLBALDH1A1LMNA | |
| SCHEMBL7924787 | 0.75 | TSHR (0.57) | HPGDAKR1C3AKR1C2CTSVCTSL | |
| SCHEMBL12777765 | 0.75 | PKM (0.43) | PKMHPGDAKR1C3AKR1C2POLB | |
| SCHEMBL18073577 | 0.75 | PKM (0.48) | PKMHPGDPOLBALDH1A1LMNA | |
| SCHEMBL23086266 | 0.75 | PKM (0.43) | PKMHPGDHTTNPSR1ALDH1A1 | |
| SCHEMBL558904 | 0.74 | SMN1; SMN2 (0.53) | PKMHPGDPOLBNPSR1ALDH1A1 | |
| SCHEMBL28300921 | 0.73 | TSHR (0.53) | PKMALDH1A1SMN1; SMN2TSHRMAPT | |
| SCHEMBL621983 | 0.73 | PKM (0.69) | PKMPOLBHTTALDH1A1LMNA |
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-3790864-A1 | QUINOLINE DERIVATIVES AND PREPARATION METHODS AND USES THEREOF | Dongguan Hec Pesticides R&D Co., Ltd. (CN) | 2021-03-17 | — | — | EP | disclosed |