Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | ULK1 | O75385 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 3/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MPO | P05164 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16494266 | 0.92 | HTR2A (0.37) | HTR2AHTR1ACDK1KDRULK1 | |
| SCHEMBL16494400 | 0.91 | CDK1 (0.43) | HTR2AHTR1ACDK1KDRHTR2C | |
| SCHEMBL16494852 | 0.89 | ULK1 (0.35) | CDK1KDRULK1DHFRSYK | |
| SCHEMBL2598786 | 0.84 | PLK2 (0.41) | CDK1KDRULK1DHFRSYK | |
| SCHEMBL2598769 | 0.82 | HTR2A (0.43) | HTR2AHTR1AHTTDHFR | |
| SCHEMBL16495033 | 0.81 | SYK (0.39) | ULK1DHFRSYK | |
| SCHEMBL2598707 | 0.81 | EPHB4 (0.42) | SYK | |
| SCHEMBL16494735 | 0.81 | KDR (0.34) | CDK1KDRULK1DHFRSYK | |
| SCHEMBL16494785 | 0.81 | HTR2C (0.42) | HTR2AKDM4EALDH1A1HTR1AHTT | |
| SCHEMBL16495205 | 0.79 | KDR (0.35) | CDK1KDRULK1DHFR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2395001-A1 | Novel pyrimidine derivatives | Chemilia AB (SE) | 2011-12-14 | — | — | EP | disclosed |