Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | CHUK | O15111 | 1/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.41 |
| ▸ | CSNK1E | P49674 | 2/20 | 0.40 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | F11 | P03951 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3920748 | 0.78 | BRD4 (0.55) | BRD4KDM4EALDH1A1SMN1; SMN2ADRA2C | |
| SCHEMBL5227614 | 0.71 | BRD4 (0.37) | BRD4BACE1SCN9A | |
| SCHEMBL28069689 | 0.71 | BRD4 (0.51) | BRD4KDM4EALDH1A1ADRA2CBRD9 | |
| SCHEMBL20703692 | 0.71 | BCAT2 (0.59) | CDC7ADRA2CIKBKBCHUKADRA1D | |
| SCHEMBL11555464 | 0.69 | BRD4 (0.54) | BRD4ADRA2CF11BACE1 | |
| SCHEMBL28856730 | 0.68 | IKBKB (0.50) | CDC7ADRA2CIKBKBCHUKADRA1D | |
| SCHEMBL3097233 | 0.67 | IKBKB (0.46) | BRD4CDC7ADRA2CIKBKBCHUK | |
| SCHEMBL31028148 | 0.66 | SCN9A (0.46) | IKBKBCHUKBACE1SCN9A | |
| SCHEMBL11552593 | 0.66 | BRD4 (0.51) | BRD4KDM4EALDH1A1SMN1; SMN2ADRA2C | |
| SCHEMBL20573271 | 0.66 | ADRA2C (0.50) | CDC7ADRA2CIKBKBCHUKBACE1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110520127-B | Piperidinyl-substituted and piperazinyl-substituted heteroaromatic carboxamides as modulators of GPR6 | 武田药品工业株式会社 | 2023-05-16 | — | — | CN | disclosed |