Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21807785 | 0.98 | CHRM1 (0.38) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL22806989 | 0.93 | — | — | |
| SCHEMBL4472253 | 0.88 | — | — | |
| SCHEMBL3082762 | 0.74 | NPC1 (0.42) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL4059081 | 0.67 | CYP1A2 (0.57) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| Methoxymethane SCHEMBL27908243 | 0.65 | RAB9A (0.50) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL27515250 | 0.64 | CHRM1 (0.34) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL4059082 | 0.64 | MDM2 (0.41) | CHRM1NPC1RAB9ACYP1A2CYP2D6 | |
| SCHEMBL28934089 | 0.64 | — | — | |
| SCHEMBL27631688 | 0.63 | NPC1 (0.33) | CHRM1NPC1RAB9ACYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6048885-A | FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 2000-04-11 | — | — | US | disclosed |