Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 3/20 | 0.32 |
| ▸ | CDK2 | P24941 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.32 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.32 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6921921 | 0.96 | CDK1 (0.34) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6824690 | 0.93 | IKBKB (0.35) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6824151 | 0.92 | IKBKB (0.34) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6824183 | 0.91 | MAPK14 (0.35) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6823654 | 0.89 | MAPK14 (0.34) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6826558 | 0.89 | HSD17B14 (0.32) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6824066 | 0.86 | HSD17B14 (0.32) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6823887 | 0.86 | CDK2 (0.37) | KMT2AMEN1HSD17B14CDK1CDK2 | |
| SCHEMBL6826271 | 0.85 | KDM4E (0.41) | CDK1CDK2ALDH1A1PKMKDM4E | |
| SCHEMBL6821385 | 0.85 | MAPK14 (0.34) | CDK1CDK2 |
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 |