Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20242449 | 0.78 | CSNK2A1 (0.37) | ALDH1A1KDM4ESMN1; SMN2MAPTPOLB | |
| SCHEMBL658050 | 0.78 | TSHR (0.54) | ALDH1A1HTTKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL16065594 | 0.76 | ACHE (0.42) | ALDH1A1KDM4EFFAR4MAPTPOLB | |
| SCHEMBL9487712 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HTTKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL17930311 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HTTSMN1; SMN2FFAR4NPSR1 | |
| SCHEMBL10980248 | 0.74 | ALDH1A1 (0.43) | ALDH1A1KDM4ESMN1; SMN2MAPTPOLB | |
| SCHEMBL12767969 | 0.74 | ALDH1A1 (0.47) | ALDH1A1HTTKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL16692253 | 0.74 | ALDH1A1 (0.49) | ALDH1A1HTTKDM4ENPSR1HPGD | |
| SCHEMBL29556815 | 0.73 | ACHE (0.56) | ALDH1A1KDM4ESMN1; SMN2FFAR4POLB | |
| SCHEMBL12517837 | 0.73 | FFAR4 (0.41) | ALDH1A1FFAR4MAPTCRHR1ACHE |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4656310-A | ANTITUMOR AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1987-04-07 | — | — | US | disclosed |
| US-4532355-A | Substituted triaryl phosphonium derivatives | HOFFMANN-LA ROCHE INC. (US) | 1985-07-30 | — | — | US | disclosed |
| US-4319048-A | ANTITUMOR AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1982-03-09 | — | — | US | disclosed |
| US-4224244-A | ANTITUMOR AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1980-09-23 | — | — | US | disclosed |
| US-4215215-A | 9-Phenyl-nonate traene compounds | HOFFMANN-LA ROCHE INC. (US) | 1980-07-29 | — | — | US | disclosed |
| US-4105681-A | ANTITUMOR AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1978-08-08 | — | — | US | disclosed |