Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.96 |
| ▸ | MEN1 | O00255 | 1/20 | 0.96 |
| ▸ | MAPT | P10636 | 1/20 | 0.96 |
| ▸ | BLM | P54132 | 1/20 | 0.96 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.96 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.32 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3182039 | 0.98 | ALDH1A1 (1.00) | ALDH1A1MEN1MAPTBLMKMT2A | |
| Pentylenetetrazol SCHEMBL6407957 | 0.98 | ALDH1A1 (1.00) | ALDH1A1MEN1MAPTBLMKMT2A | |
| Pentylenetetrazol SCHEMBL9838533 | 0.98 | ALDH1A1 (1.00) | ALDH1A1MEN1MAPTBLMKMT2A | |
| Pentylenetetrazol SCHEMBL15057132 | 0.96 | ALDH1A1 (0.96) | ALDH1A1MEN1MAPTBLMKMT2A | |
| Pentylenetetrazol SCHEMBL10408117 | 0.96 | ALDH1A1 (0.96) | ALDH1A1MEN1MAPTBLMKMT2A | |
| SCHEMBL2211329 | 0.96 | — | — | |
| Pentylenetetrazol SCHEMBL28326199 | 0.92 | ALDH1A1 (0.88) | ALDH1A1MEN1MAPTBLMKMT2A | |
| SCHEMBL2212322 | 0.89 | — | — | |
| Pentylenetetrazol SCHEMBL2260235 | 0.85 | ALDH1A1 (0.76) | ALDH1A1MEN1MAPTBLMKMT2A | |
| Biphenyl SCHEMBL7633644 | 0.84 | ALDH1A1 (0.73) | ALDH1A1MEN1MAPTBLMKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0188585-A1 | RUTHENIUM COMPOSITIONS HAVING A TUMOR INHIBITING ACTIVITY | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1986-07-30 | — | — | EP | disclosed |
| WO-1986000804-A1 | RUTHENIUM COMPOSITIONS HAVING A TUMOR INHIBITING ACTIVITY | BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT M (DE) | 1986-02-13 | — | — | WO | disclosed |