Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 3/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.38 |
| ▸ | CDK4 | P11802 | 2/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.37 |
| ▸ | COMT | P21964 | 1/20 | 0.37 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | CDKL1 | Q00532 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL6826434 | 0.88 | HDAC8 (0.39) | HDAC8KDM1AHDAC1HDAC6HDAC2 | |
| SCHEMBL6826746 | 0.76 | CDK1 (0.44) | JAK2CDK2AKT3AURKBCOMT | |
| SCHEMBL6826342 | 0.74 | KMT2A (0.40) | CDK2HSD17B14 | |
| SCHEMBL6824582 | 0.74 | CYP46A1 (0.39) | CDK2HSD17B14CYP19A1 | |
| SCHEMBL6823658 | 0.73 | HSD17B14 (0.36) | KDM1AHDAC1CDK2HSD17B14 | |
| SCHEMBL6824603 | 0.73 | MAPT (0.39) | CDK2HSD17B14RPS6KA3 | |
| SCHEMBL6917094 | 0.73 | CDK2 (0.42) | JAK2CDK4CDK2HSD17B14PDK1 | |
| SCHEMBL6823630 | 0.71 | CDK1 (0.49) | CDK2HSD17B14 | |
| SCHEMBL6824771 | 0.71 | CDK1 (0.38) | JAK2LOXL2CDK2HSD17B14AURKB | |
| SCHEMBL6824151 | 0.71 | IKBKB (0.34) | KDM1AHDAC1LOXL2CDK2HSD17B14 |
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 |