Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7679097 | 0.95 | CYP2C19 (0.48) | CYP2C19CYP3A4CYP2D6KMT2AMEN1 | |
| SCHEMBL7675925 | 0.94 | CYP2D6 (0.45) | CYP2C19CYP3A4CYP2D6SMN1; SMN2KDM1A | |
| SCHEMBL7681127 | 0.85 | MKNK1 (0.40) | CYP2C19CYP3A4CYP2D6KMT2AALDH1A1 | |
| SCHEMBL7672759 | 0.74 | KDM4E (0.43) | CYP2C19KMT2AMEN1SMN1; SMN2POLB | |
| SCHEMBL7675540 | 0.71 | HRH3 (0.46) | CYP3A4ALDH1A1LMNA | |
| SCHEMBL7677919 | 0.71 | CYP2C19 (0.67) | CYP2C19CYP3A4CYP2D6KMT2AMEN1 | |
| SCHEMBL3175221 | 0.70 | CYP2C19 (0.80) | CYP2C19CYP3A4CYP2D6KMT2AMEN1 | |
| SCHEMBL5596422 | 0.69 | CDK4 (0.47) | CYP2C19CYP3A4CYP2D6KMT2ASMN1; SMN2 | |
| SCHEMBL7675337 | 0.68 | PIK3R1 (0.40) | GAAKDM4ELMNA | |
| SCHEMBL7673338 | 0.68 | HRH3 (0.40) | — |
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-6455520-B1 | TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS | ASTRA ZENECA AB (SE) | 2002-09-24 | — | — | US | disclosed |