Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 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 | |
|---|---|---|---|---|
| SCHEMBL3192520 | 0.76 | TDP1 (0.38) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11535645 | 0.75 | ALDH1A1 (0.33) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL8996568 | 0.72 | TDP1 (0.41) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL9298779 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11533600 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11541316 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11534624 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11636805 | 0.66 | TDP1 (0.37) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL11569482 | 0.65 | LMNA (0.44) | ALDH1A1TDP1KDM4ELMNAMEN1 | |
| SCHEMBL20346213 | 0.62 | TDP1 (0.45) | ALDH1A1TDP1KDM4ELMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4136120-A | GRIGNARD REACTION, CHELATION, HYDROLYSIS, DEHYDRATION | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1979-01-23 | — | — | US | disclosed |
| US-4136208-A | FLAVORING WITH SUBSTITUTED NORBORNANE DERIVATIVES | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1979-01-23 | — | — | US | disclosed |