Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | PTGER1 | P34995 | 5/20 | 0.44 |
| ▸ | CNR1 | P21554 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.38 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11117488 | 0.86 | NPC1 (0.47) | NPC1RAB9APTGER1CNR1ALDH1A1 | |
| SCHEMBL148140 | 0.79 | NPC1 (0.48) | NPC1RAB9APTGER1CNR1ALDH1A1 | |
| SCHEMBL27970564 | 0.77 | NPC1 (0.48) | NPC1RAB9APTGER1CNR1ALDH1A1 | |
| SCHEMBL10751205 | 0.76 | SMN1; SMN2 (0.45) | NPC1RAB9AALDH1A1NPSR1CYP1A2 | |
| SCHEMBL7200151 | 0.73 | MAPT (0.42) | NPC1RAB9AALDH1A1NPSR1CYP1A2 | |
| SCHEMBL27542976 | 0.73 | SMN1; SMN2 (0.47) | NPC1RAB9AALDH1A1NPSR1CYP1A2 | |
| SCHEMBL10673937 | 0.73 | NPC1 (0.46) | NPC1RAB9APTGER1CNR1ALDH1A1 | |
| SCHEMBL10668454 | 0.73 | RAB9A (0.46) | NPC1RAB9APTGER1CNR1ALDH1A1 | |
| SCHEMBL4889275 | 0.72 | ABCB1 (0.45) | NPC1RAB9AALDH1A1NPSR1CYP1A2 | |
| SCHEMBL54326 | 0.72 | ABCB1 (0.45) | NPC1RAB9AALDH1A1NPSR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114158553-A | Novel pesticide preparation and preparation method thereof | 南开沧州渤海新区绿色化工研究有限公司 | 2022-03-11 | — | — | CN | disclosed |