Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL20077710 | 0.90 | — | — | |
| SCHEMBL13625560 | 0.90 | — | — | |
| SCHEMBL9492556 | 0.90 | — | — | |
| SCHEMBL10505809 | 0.75 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4KDM4E | |
| SCHEMBL10505799 | 0.75 | CHRNB2 (0.39) | CHRNB2CHRNB4CHRNA3CHRNA4KDM4E | |
| SCHEMBL1577796 | 0.73 | CHRNB2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| SCHEMBL1577795 | 0.73 | CHRNB2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| SCHEMBL1700958 | 0.73 | CHRNB2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4MAPT | |
| SCHEMBL4109881 | 0.72 | — | — | |
| SCHEMBL4543079 | 0.72 | ALDH1A1 (0.45) | TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1149067-B1 | 7-ARYL-6(Z)HEPTATRIENOIC ACID RETINAMIDES AS APOPTOSIS INDUCING COMPOUNDS AND THEIR USE AS ANTI-CANCER AGENTS | HOFFMANN LA ROCHE (CH) | 2004-02-25 | — | — | EP | disclosed |