Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.36 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.36 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.36 |
| ▸ | CHRNG | P07510 | 1/20 | 0.36 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CHRND | Q07001 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4014224 | 0.85 | NOS1 (0.50) | CHRNB4CHRNA3CHEK1NOS3NOS1 | |
| SCHEMBL4858610 | 0.83 | MCHR1 (0.44) | CDK2CDK9CDK5NOS3NOS1 | |
| SCHEMBL4790009 | 0.74 | CHRNA1 (0.40) | CDK2CDK9CDK5CHRNB4CHRNA3 | |
| SCHEMBL4018111 | 0.67 | NOS1 (0.44) | CHRNB4CHRNA3CHEK1NOS3NOS1 | |
| SCHEMBL11456174 | 0.67 | CHRNB4 (0.74) | CHRNB4CHRNA3CHRNB2CHRNA4CHEK1 | |
| SCHEMBL221161 | 0.66 | NOS1 (0.57) | NOS3NOS1KDM4E | |
| SCHEMBL4858606 | 0.66 | NOS3 (0.47) | NOS3NOS1KDM4E | |
| SCHEMBL220876 | 0.64 | CHEK1 (0.45) | CHRNB4CHRNA3CHEK1NOS3NOS1 | |
| SCHEMBL11449105 | 0.64 | CHRNB4 (0.68) | CHRNB4CHRNA3CHRNB2CHRNA4PIM1 | |
| SCHEMBL252141 | 0.64 | NOS1 (0.79) | NOS3NOS1KDM4E |
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-2006094248-A1 | ARYL-SUBSTITUTED CYCLIC SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2006-09-08 | — | — | WO | disclosed |