Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 7/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 6/20 | 0.43 |
| ▸ | DYRK2 | Q92630 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.38 |
| ▸ | CLK1 | P49759 | 3/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.37 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.37 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.37 |
| ▸ | CLK2 | P49760 | 1/20 | 0.37 |
| ▸ | CLK3 | P49761 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2416319 | 0.81 | ALDH1A1 (0.53) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| SCHEMBL339129 | 0.81 | DYRK1A (0.61) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL8556369 | 0.78 | DYRK1A (0.58) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| Hydrochloric Acid SCHEMBL8556367 | 0.78 | DYRK1A (0.58) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| SCHEMBL4033357 | 0.78 | ALDH1A1 (0.69) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| SCHEMBL5372412 | 0.76 | ITGB2 (0.52) | DYRK1ADYRK1BDYRK2ALDH1A1HSD17B10 | |
| SCHEMBL14980946 | 0.75 | ALDH1A1 (0.45) | ALDH1A1HSD17B10TDP1CYP2A6 | |
| SCHEMBL1652999 | 0.75 | DYRK1A (0.43) | DYRK1ADYRK1BDYRK2KCNH2PRKCI | |
| SCHEMBL14409815 | 0.75 | CYP2A6 (0.46) | DYRK1AALDH1A1HSD17B10TDP1KCNH2 | |
| SCHEMBL8344049 | 0.75 | MAOA (0.45) | DYRK1AHSD17B10TDP1ERN1PRKCI |
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-1222174-B1 | IMIDAZOL-4-YLMETHANOLS USED AS INHIBITORS OF STEROID C17-20 LYASE | TAKEDA PHARMACEUTICAL (JP) | 2009-05-27 | — | — | EP | disclosed |
| US-6649643-B1 | Antitumor, anticarcinogenic, and antimetastasis agents; benign prostatic hyperplasia, alopecia, endometriosis, uterine myoma, hirsutism, virilism, precocious puberty, mastopathy, and polycystic overay syndrome treatment | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-11-18 | — | — | US | disclosed |