Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 2/20 | 0.55 |
| ▸ | CDK2 | P24941 | 2/20 | 0.55 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 6/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | HTR1D | P28221 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6823630 | 0.96 | CDK1 (0.49) | CDK1CDK2HSD17B14HRH4HTR3A | |
| SCHEMBL6825113 | 0.90 | CDK1 (0.44) | CDK1CDK2HRH4HTR1AADRA2A | |
| SCHEMBL6826440 | 0.90 | CDK1 (0.55) | CDK1CDK2 | |
| SCHEMBL7064551 | 0.86 | ADORA2A (0.41) | CDK1CDK2HSD17B14HRH4 | |
| SCHEMBL6824426 | 0.85 | CDK1 (0.43) | CDK1CDK2HSD17B14HRH4 | |
| SCHEMBL6820798 | 0.84 | CDK1 (0.40) | CDK1CDK2HSD17B14HRH4 | |
| SCHEMBL6823887 | 0.82 | CDK2 (0.37) | CDK1CDK2HSD17B14HRH3 | |
| SCHEMBL6821420 | 0.81 | CDK1 (0.43) | CDK1CDK2HRH4 | |
| SCHEMBL6826342 | 0.81 | KMT2A (0.40) | CDK1CDK2HSD17B14 | |
| SCHEMBL6824603 | 0.79 | MAPT (0.39) | CDK1CDK2HSD17B14 |
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-2004080979-A1 | NOVEL 3-(2-AMINO-4-PYRIMIDINYL)-4-HYDROXYPHENYL KETONE DERIVATIVES | LG LIFE SCIENCES LTD. (KR) | 2004-09-23 | — | — | WO | disclosed |