Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 3/20 | 0.43 |
| ▸ | NOS3 | P29474 | 2/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.40 |
| ▸ | HTR3B | O95264 | 2/20 | 0.40 |
| ▸ | HTR3A | P46098 | 2/20 | 0.40 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.40 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.40 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.38 |
| ▸ | FEN1 | P39748 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11443002 | 1.00 | NOS1 (0.43) | NOS1NOS3HTR3EHTR3BHTR3A | |
| SCHEMBL28147978 | 0.78 | KDM4E (0.45) | NOS1NOS3HTR3EHTR3BHTR3A | |
| SCHEMBL406589 | 0.77 | TSHR (0.39) | HPGDERCC5FEN1NPC1RAB9A | |
| SCHEMBL31204265 | 0.77 | TSHR (0.39) | HPGDERCC5FEN1NPC1RAB9A | |
| SCHEMBL406588 | 0.77 | TSHR (0.39) | HPGDERCC5FEN1NPC1RAB9A | |
| SCHEMBL14904944 | 0.77 | NOS1 (0.41) | NOS1NOS3HTR3EHTR3BHTR3A | |
| SCHEMBL28296397 | 0.76 | CYP2D6 (0.56) | NOS1NOS3HTR3EHTR3BHTR3A | |
| SCHEMBL5201137 | 0.75 | MAOA (0.39) | HPGDERCC5FEN1NPC1RAB9A | |
| SCHEMBL5201132 | 0.75 | MAOA (0.39) | HPGDERCC5FEN1NPC1RAB9A | |
| Hydrochloric Acid SCHEMBL11770197 | 0.74 | CYP2D6 (0.55) | NOS1NOS3HTR3EHTR3BHTR3A |
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 |
|---|---|---|---|---|---|---|---|
| JP-55019256-A | — | — | None | — | — | JP | disclosed |
| JP-S5519256-A | PROTECTANT OF RICE PLANT AGAINST SHEATH BLIGHT | HOKKO CHEM IND CO LTD | 1980-02-09 | — | — | JP | disclosed |