Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9362547 | 0.87 | ALDH1A1 (0.37) | NPC1RAB9ASMN1; SMN2MAPK1 | |
| Hydrochloric Acid SCHEMBL11050519 | 0.86 | ALDH1A1 (0.36) | NPC1RAB9ASMN1; SMN2MAPK1 | |
| SCHEMBL9879624 | 0.82 | RAB9A (0.56) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9879622 | 0.82 | RAB9A (0.56) | NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10942155 | 0.80 | APAF1 (0.39) | — | |
| SCHEMBL10869428 | 0.77 | — | — | |
| SCHEMBL9617137 | 0.77 | CYP2C9 (0.44) | MAPK1 | |
| SCHEMBL9340714 | 0.77 | CYP2C9 (0.44) | MAPK1 | |
| SCHEMBL11093051 | 0.76 | ALDH1A1 (0.36) | SMN1; SMN2 | |
| SCHEMBL10973103 | 0.75 | THRA (0.40) | NPC1RAB9ASMN1; SMN2MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-59098079-A | — | — | None | — | — | JP | disclosed |
| JP-59082382-A | — | — | None | — | — | JP | disclosed |
| JP-S5998079-A | M-HALOGEN-SUBSTITUTED METADIOXANE ESTER | CHISSO CORP | 1984-06-06 | — | — | JP | disclosed |
| JP-S5982382-A | M-DIOXANE ESTER CONTAINING HALOGEN | CHISSO CORP | 1984-05-12 | — | — | JP | disclosed |