Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL11767301 | 1.00 | ALDH1A1 (0.43) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11768079 | 0.90 | LMNA (0.47) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11768073 | 0.90 | LMNA (0.47) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11746947 | 0.90 | LMNA (0.47) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11746945 | 0.90 | LMNA (0.47) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11761143 | 0.87 | ALDH1A1 (0.41) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11761150 | 0.87 | ALDH1A1 (0.41) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11811614 | 0.86 | ALDH1A1 (0.45) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11811618 | 0.86 | ALDH1A1 (0.45) | ALDH1A1LMNACYP3A4TDP1CHRNB2 | |
| SCHEMBL11765041 | 0.85 | ALDH1A1 (0.44) | ALDH1A1LMNACYP3A4TDP1KDM1A |
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-4021461-A | INSECTICIDES | ZOECON CORPORATION (US) | 1977-05-03 | — | — | US | disclosed |