Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 2/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK3 | P49761 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.38 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.38 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 3/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30486 | 0.92 | IDO1 (0.48) | IDO1HSP90AA1CDK2HCAR2METAP2 | |
| Hydrochloric Acid SCHEMBL999376 | 0.90 | IDO1 (0.47) | IDO1HSP90AA1CDK2HCAR2METAP2 | |
| SCHEMBL4141797 | 0.77 | RAF1 (0.40) | IDO1HSP90AA1CDK2MKNK1 | |
| SCHEMBL17255318 | 0.76 | HASPIN (0.45) | FGFR1CLK1DYRK1A | |
| SCHEMBL29563426 | 0.76 | IDO1 (0.54) | IDO1HSP90AA1CDK2METAP2FGFR1 | |
| SCHEMBL276443 | 0.76 | IDO1 (0.54) | IDO1HSP90AA1CDK2METAP2FGFR1 | |
| SCHEMBL29450787 | 0.73 | HPRT1 (0.54) | IDO1HSP90AA1CDK2HCAR2METAP2 | |
| SCHEMBL27074503 | 0.73 | HPRT1 (0.54) | IDO1HSP90AA1CDK2HCAR2METAP2 | |
| SCHEMBL7208201 | 0.73 | PTPRC (0.41) | IDO1ALDH1A1TDP1 | |
| Indazole SCHEMBL15577295 | 0.72 | HSP90AA1 (0.79) | IDO1HSP90AA1CDK2METAP2FGFR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1976936-A | Tetrahydroquinolines | MERCK PATENT GMBH (DE) | 2007-06-06 | — | — | CN | disclosed |
| CN-1878556-A | Combinations of drugs for the treatment of neoplasms | COMBINATORX INC (US) | 2006-12-13 | — | — | CN | disclosed |
| CN-1829509-A | Pharmaceutical composition for treating tumors | COMBINATORX INC (US) | 2006-09-06 | — | — | CN | disclosed |
| CN-1681511-A | Combinations of drugs for the treatment of neoplasms | COMBINATORX INC (US) | 2005-10-12 | — | — | CN | disclosed |