Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 11/20 | 1.00 |
| ▸ | LIMK1 | P53667 | 8/20 | 1.00 |
| ▸ | CDC7 | O00311 | 3/20 | 1.00 |
| ▸ | DBF4 | Q9UBU7 | 2/20 | 1.00 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.61 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.53 |
| ▸ | PLK4 | O00444 | 1/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.53 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL12807147 | 1.00 | CLK1 (1.00) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL16281249 | 0.80 | CLK1 (0.67) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL9042411 | 0.80 | CLK1 (0.67) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL30093319 | 0.80 | CLK1 (0.67) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL19738188 | 0.79 | CLK1 (0.65) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL30186939 | 0.79 | CLK1 (0.65) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL14115537 | 0.76 | CLK1 (0.61) | CLK1LIMK1CDC7DBF4KDM4E | |
| SCHEMBL20609579 | 0.76 | CLK1 (0.61) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL14090789 | 0.76 | CLK1 (0.61) | CLK1LIMK1CDC7DBF4CDK5 | |
| SCHEMBL20120214 | 0.76 | CLK1 (0.61) | CLK1LIMK1CDC7DBF4CDK5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116178391-A | Forward allosteric modulators of muscarinic acetylcholine receptor M4 | 范德比尔特大学 | 2023-05-30 | — | — | CN | disclosed |
| CN-109310668-B | Positive allosteric modulators of muscarinic acetylcholine receptor M4 | 范德比尔特大学 | 2023-01-24 | — | — | CN | disclosed |