Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 10/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 6/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.47 |
| ▸ | HTR2B | P41595 | 4/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | KIT | P10721 | 6/20 | 0.41 |
| ▸ | FLT3 | P36888 | 6/20 | 0.41 |
| ▸ | CCNK | O75909 | 1/20 | 0.41 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 2/20 | 0.40 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.39 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 4/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | IGF1R | P08069 | 1/20 | 0.37 |
| ▸ | EPHA1 | P21709 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6457950 | 0.80 | MCHR1 (0.60) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| Hydrochloric Acid SCHEMBL6831539 | 0.80 | MCHR1 (0.57) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| Hydrochloric Acid SCHEMBL7068754 | 0.78 | MCHR1 (0.61) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| SCHEMBL5670582 | 0.78 | KIT (0.45) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| SCHEMBL27632454 | 0.76 | MCHR1 (0.55) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| SCHEMBL6457955 | 0.76 | MCHR1 (0.52) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| Hydrochloric Acid SCHEMBL6873433 | 0.76 | MCHR1 (0.61) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| SCHEMBL6467364 | 0.74 | ULK1 (0.51) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| SCHEMBL6467357 | 0.74 | ULK1 (0.51) | MCHR1ADRA2AADRA1AHTR2BHTR1A | |
| Trifluoroacetic Acid SCHEMBL6464140 | 0.72 | MCHR1 (0.63) | MCHR1ADRA2AADRA1AHTR2BHTR1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | disclosed |