Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.45 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CCR1 | P32246 | 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 | |
|---|---|---|---|---|
| SCHEMBL20600971 | 0.91 | ALDH1A1 (0.46) | IDO1ALDH1A1NAMPTGPR119SMYD3 | |
| SCHEMBL20601136 | 0.89 | IDO1 (0.49) | IDO1ALDH1A1CYP2C9GPR119KDM4E | |
| SCHEMBL20600950 | 0.89 | IDO1 (0.49) | IDO1ALDH1A1CYP2C9GPR119KDM4E | |
| SCHEMBL20616363 | 0.89 | IDO1 (0.53) | IDO1ALDH1A1CHRNA1CYP2C8CYP2C9 | |
| SCHEMBL20600914 | 0.87 | CCR1 (0.42) | IDO1ALDH1A1CYP2C9CYP2C19GPR119 | |
| SCHEMBL20600913 | 0.87 | CCR1 (0.42) | IDO1ALDH1A1CYP2C9CYP2C19GPR119 | |
| SCHEMBL20600935 | 0.83 | IDO1 (0.48) | IDO1ALDH1A1CHRNA1CYP2C8CYP2C9 | |
| SCHEMBL20600934 | 0.83 | IDO1 (0.48) | IDO1ALDH1A1CHRNA1CYP2C8CYP2C9 | |
| SCHEMBL20615754 | 0.82 | KDM4E (0.50) | ALDH1A1NAMPTKDM4ESMN1; SMN2 | |
| SCHEMBL20601177 | 0.80 | ALDH1A1 (0.45) | IDO1ALDH1A1NAMPTSMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019003141-A1 | MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-01-03 | — | — | WO | disclosed |