Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | NME2 | P22392 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 1/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ROS1 | P08922 | 1/20 | 0.38 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL6923124 | 0.86 | CDK1 (0.53) | CDK1CDK2ALDH1A1KMT2AROS1 | |
| SCHEMBL7068093 | 0.84 | RAF1 (0.45) | CDK1CDK2HSD17B10HPGDBRD4 | |
| SCHEMBL6820704 | 0.82 | CDK1 (0.59) | CDK1CDK2ALDH1A1KMT2AHSD17B10 | |
| SCHEMBL6821420 | 0.79 | CDK1 (0.43) | CDK1CDK2KMT2AMAPK14 | |
| SCHEMBL6823947 | 0.78 | MRGPRX4 (0.43) | BRD4 | |
| SCHEMBL6823543 | 0.77 | MRGPRX4 (0.42) | BRD4 | |
| SCHEMBL6916270 | 0.76 | MRGPRX4 (0.41) | KMT2ALMNAKDM4EMAPK1TDP1 | |
| SCHEMBL6826271 | 0.75 | KDM4E (0.41) | CDK1CDK2ALDH1A1PKMKDM4E | |
| SCHEMBL6824190 | 0.73 | MAPK14 (0.43) | CDK1CDK2ALDH1A1KDM4EGAA | |
| SCHEMBL6824305 | 0.73 | MAPK14 (0.48) | CDK1CDK2ALDH1A1KMT2AHSD17B10 |
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 |