Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 5/20 | 0.57 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5249356 | 0.86 | FFAR1 (0.66) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28772070 | 0.82 | FFAR1 (0.50) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28256625 | 0.76 | FFAR1 (0.50) | FFAR1FFAR4KCNH2ALDH1A1APP | |
| SCHEMBL10768214 | 0.75 | CYP1A2 (0.64) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL29187194 | 0.75 | GRM5 (0.54) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17743740 | 0.74 | FFAR1 (0.61) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10798421 | 0.74 | FFAR1 (0.61) | FFAR1FFAR4MEN1KMT2AGRM5 | |
| SCHEMBL28585298 | 0.73 | FFAR1 (0.51) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28476337 | 0.73 | FFAR1 (0.51) | FFAR1FFAR4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL16050106 | 0.73 | FFAR1 (0.77) | FFAR1FFAR4ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-110256365-B | Method for preparing benzodiazepine derivative by catalysis of dichlorotitanocene | 陕西师范大学 | 2022-06-07 | — | — | CN | disclosed |