Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5221988 | 0.79 | CHRM2 (0.50) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL28013981 | 0.78 | LMNA (0.40) | CYP1A2CYP2D6CYP2C9MEN1KMT2A | |
| SCHEMBL28086157 | 0.77 | LMNA (0.51) | CYP1A2CYP2D6CYP2C9MEN1KMT2A | |
| SCHEMBL28049253 | 0.77 | LMNA (0.47) | CHRM1CYP1A2CYP2D6CYP2C9MEN1 | |
| SCHEMBL27968133 | 0.77 | ATM (0.38) | CYP2D6MEN1KMT2AALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL28314858 | 0.76 | LMNA (0.54) | CYP1A2CYP2D6CYP2C9MEN1KMT2A | |
| SCHEMBL27999947 | 0.76 | GAA (0.53) | CHRM2CHRM1CHRM3CYP1A2CYP2D6 | |
| SCHEMBL11035416 | 0.75 | CHRM2 (0.50) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL28063498 | 0.74 | ATM (0.37) | CHRM2CHRM4CHRM5CHRM1CHRM3 | |
| SCHEMBL27995211 | 0.74 | ATM (0.41) | CHRM1CYP2D6MEN1KMT2AALDH1A1 |
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-104321330-A | Rhodium catalyst and process for producing amine compound | TAKEDA PHARMACEUTICAL | 2015-01-28 | — | — | CN | disclosed |