Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.95 |
| ▸ | IDO1 | P14902 | 1/20 | 0.95 |
| ▸ | CDK2 | P24941 | 1/20 | 0.95 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.79 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.53 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.53 |
| ▸ | CLK1 | P49759 | 1/20 | 0.53 |
| ▸ | CLK2 | P49760 | 1/20 | 0.53 |
| ▸ | CLK3 | P49761 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.53 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.53 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.53 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.53 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.53 |
| ▸ | NOS1 | P29475 | 7/20 | 0.48 |
| ▸ | METAP2 | P50579 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Indazole SCHEMBL1221882 | 0.97 | HSP90AA1 (1.00) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL29355507 | 0.97 | — | — | |
| Indazole SCHEMBL6295 | 0.97 | — | — | |
| Indazole SCHEMBL5221603 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL7371212 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL9407408 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL31338906 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL5420749 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL21058156 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A | |
| Indazole SCHEMBL3540508 | 0.95 | HSP90AA1 (0.95) | HSP90AA1IDO1CDK2ABCB1DYRK1A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103384661-B | Mineralocorticoid receptor antagonists | 默沙东公司 | 2016-08-10 | — | — | CN | claimed |
| CN-108409626-A | The preparation method of ovarian cancer resistance medicament Rucaparib key intermediates | 程春晓 | 2018-08-17 | — | — | CN | disclosed |
| CN-104902893-B | Mineralocorticoid receptor antagonists | 默沙东公司 | 2017-11-28 | — | — | CN | disclosed |
| CN-106854172-A | A kind of preparation method of the methyl formate of 6 fluorine 1H indazoles 4 | 山东轩德医药科技有限公司 | 2017-06-16 | — | — | CN | disclosed |
| CN-106854172-A | A kind of preparation method of the methyl formate of 6 fluorine 1H indazoles 4 | 山东轩德医药科技有限公司 | 2017-06-16 | — | — | CN | disclosed |
| CN-104902893-A | Mineralocorticoid receptor antagonists | MERCK SHARP & DOHME | 2015-09-09 | — | — | CN | disclosed |