Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNQ3 | O43525 | 2/20 | 0.48 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.48 |
| ▸ | KCNQ4 | P56696 | 2/20 | 0.48 |
| ▸ | KCNQ5 | Q9NR82 | 2/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.45 |
| ▸ | EGFR | P00533 | 3/20 | 0.42 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15712533 | 0.83 | KCNQ3 (0.53) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL15712529 | 0.80 | KCNQ3 (0.54) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL17067712 | 0.75 | EGFR (0.41) | ERBB2EGFRERBB4NR1I2HDAC3 | |
| SCHEMBL15712561 | 0.71 | ERBB2 (0.51) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL17067776 | 0.71 | SYK (0.49) | ERBB2EGFRERBB4CDK1CDK4 | |
| SCHEMBL17067816 | 0.71 | EGFR (0.43) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL15712122 | 0.71 | ERBB2 (0.48) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL20850689 | 0.71 | ERBB2 (0.48) | KCNQ3KCNQ2KCNQ4KCNQ5ERBB2 | |
| SCHEMBL15712210 | 0.71 | ERBB2 (0.48) | ERBB2EGFRERBB4NR1I2CDK1 | |
| SCHEMBL15712256 | 0.70 | ERBB2 (0.46) | ERBB2EGFRERBB4NR1I2CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9624215-B2 | Amine derivative or salt thereof | TOYAMA CHEMICAL CO., LTD. (JP) | 2017-04-18 | — | — | US | disclosed |