Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | KDM4A | O75164 | 1/20 | 0.50 |
| ▸ | KDM5C | P41229 | 1/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.50 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.50 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 2/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.49 |
| ▸ | CCNK | O75909 | 1/20 | 0.48 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10072164 | 0.87 | KDM4A (0.44) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL27850091 | 0.86 | CCNK (0.49) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL27924063 | 0.80 | KDM4A (0.47) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL27959619 | 0.79 | PTGDR2 (0.43) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL2722435 | 0.78 | KDM4A (0.42) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL718773 | 0.73 | CCNK (0.44) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL2724281 | 0.73 | CCNK (0.62) | CYP19A1GSK3BFLT3CCNKCDK12 | |
| SCHEMBL13734665 | 0.73 | CYP19A1 (0.59) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL22510634 | 0.72 | CYP19A1 (0.82) | CYP19A1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL10104608 | 0.71 | EGLN1 (0.44) | CYP19A1KDM4AKDM5CKDM4CKDM2A |
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-103168042-B | 7-([1,2,3]-triazole-4-yl) pyrrolo-[2,3-b] pyrazines derivatives | MERCK PATENT GMBH (DE) | 2015-10-21 | — | — | CN | disclosed |