Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 9/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DNM2 | P50570 | 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 | |
|---|---|---|---|---|
| SCHEMBL3400985 | 0.86 | ADRA2A (0.53) | KCNH3ADRA2AABL1GPR84ALDH1A1 | |
| SCHEMBL28700733 | 0.84 | ABL1 (0.55) | KCNH3ADRA2AABL1GPR84ALDH1A1 | |
| SCHEMBL6231601 | 0.84 | TRPA1 (0.41) | — | |
| SCHEMBL20564038 | 0.82 | MAPT (0.44) | KCNH3ADRA2AABL1ALDH1A1 | |
| SCHEMBL6231348 | 0.80 | ABL1 (0.49) | KCNH3ABL1ALDH1A1 | |
| SCHEMBL17351160 | 0.79 | ABL1 (0.47) | KCNH3ADRA2AABL1GPR84DNM2 | |
| SCHEMBL19968723 | 0.79 | ABL1 (0.51) | KCNH3ABL1ALDH1A1 | |
| SCHEMBL7649344 | 0.79 | ABL1 (0.51) | KCNH3ABL1ALDH1A1 | |
| SCHEMBL1567049 | 0.78 | KCNH3 (0.65) | KCNH3ABL1ALDH1A1 | |
| SCHEMBL8958338 | 0.78 | THRB (0.52) | KCNH3ADRA2AABL1GPR84ALDH1A1 |
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-1530562-A1 | OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME | Central Glass Company, Limited (JP) | 2005-05-18 | — | — | EP | disclosed |
| WO-2004022521-A1 | OPTICALLY ACTIVE 1-(FLUORO-,TRIFLUOROMETHYL-OR TRIFLUOROMETHOXY-SUBSTITUTED PHENYL)ALKYLAMINE N-MONOALKYL DERIVATIVES AND PROCESS FOR PRODUCING SAME | CENTRAL GLASS COMPANY, LIMITED (JP) | 2004-03-18 | — | — | WO | disclosed |