Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | APEX1 | P27695 | 2/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.40 |
| ▸ | PDE2A | O00408 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28223188 | 0.86 | MAOB (0.42) | NPC1RAB9AADORA2AADORA1MAOB | |
| SCHEMBL29131813 | 0.78 | PDE2A (0.36) | NPC1CASP3RAB9ASENP8SENP7 | |
| SCHEMBL30414249 | 0.78 | PDE2A (0.36) | NPC1CASP3RAB9ASENP8SENP7 | |
| SCHEMBL3937884 | 0.74 | MAOB (0.37) | PDE2APDE10AMAOBHSD11B1KDM4E | |
| SCHEMBL30178120 | 0.74 | MAOB (0.37) | PDE2APDE10AMAOBHSD11B1KDM4E | |
| SCHEMBL27958830 | 0.72 | GABRG2 (0.38) | NPC1RAB9AADORA2AADORA1PDE10A | |
| SCHEMBL5224594 | 0.72 | ADORA2A (0.41) | NPC1RAB9AL3MBTL1ADORA2AADORA1 | |
| SCHEMBL2052255 | 0.71 | RAB9A (0.42) | NPC1CASP3RAB9ASENP8SENP7 | |
| SCHEMBL68893 | 0.70 | NPC1 (0.47) | NPC1CASP3RAB9ASENP8SENP7 | |
| SCHEMBL1075088 | 0.70 | L3MBTL1 (0.44) | NPC1CASP3RAB9ASENP8SENP7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104507318-B | The composition of fungicide including biocontrol agent and from electron transport chain complex III inhibitor | 拜尔农作物科学股份公司 | 2018-12-25 | — | — | CN | claimed |
| CN-104363758-B | Compositions comprising biological control agents and pesticides | 拜耳作物科学公司 | 2017-02-08 | — | — | CN | claimed |