Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.69 |
| ▸ | MEN1 | O00255 | 2/20 | 0.69 |
| ▸ | GAA | P10253 | 1/20 | 0.69 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.69 |
| ▸ | MAPT | P10636 | 1/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM6B | O15054 | 3/20 | 0.43 |
| ▸ | KDM4A | O75164 | 3/20 | 0.43 |
| ▸ | KDM4D | Q6B0I6 | 3/20 | 0.43 |
| ▸ | KDM3B | Q7LBC6 | 3/20 | 0.43 |
| ▸ | HIF1AN | Q9NWT6 | 3/20 | 0.43 |
| ▸ | KDM5B | Q9UGL1 | 3/20 | 0.43 |
| ▸ | KDM2A | Q9Y2K7 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11246068 | 0.94 | CYP2C19 (0.79) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL11238675 | 0.94 | CYP2C19 (0.79) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL10823650 | 0.83 | KMT2A (0.53) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL4950435 | 0.78 | KMT2A (0.50) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL31282172 | 0.77 | KMT2A (0.49) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL26779948 | 0.77 | TK1 (0.60) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL7213260 | 0.77 | CYP1A2 (0.55) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL10823643 | 0.76 | HTT (0.56) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL425895 | 0.76 | KMT2A (0.49) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 | |
| SCHEMBL11093962 | 0.76 | LMNA (0.60) | CYP2C19CYP1A2KMT2ACYP2C9MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4329460-A | ANTICANCER AGENTS, ANTIVIRAL AGENTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1982-05-11 | — | — | US | disclosed |