Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | KDM4A | O75164 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.40 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.40 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.39 |
| ▸ | TEK | Q02763 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 2/20 | 0.39 |
| ▸ | CCNK | O75909 | 1/20 | 0.39 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL285634 | 0.87 | CCNK (0.42) | KDM4AKDM5CKDM4CKDM2AKDM3A | |
| SCHEMBL10463930 | 0.86 | KDM4A (0.42) | NTRK1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL2722435 | 0.83 | KDM4A (0.42) | KDM4AKDM5CKDM4CKDM2AKDM3A | |
| SCHEMBL299949 | 0.82 | KDR (0.47) | EGLN1EPHB4TEKKDRCDC7 | |
| SCHEMBL294699 | 0.80 | KDM1A (0.40) | EGLN1CCNKCDK12MEN1KMT2A | |
| SCHEMBL10325505 | 0.80 | EGLN1 (0.39) | KDM4AKDM5CKDM4CKDM2AKDM3A | |
| SCHEMBL27924063 | 0.79 | KDM4A (0.47) | NTRK1KDM4AKDM5CKDM4CKDM2A | |
| SCHEMBL718773 | 0.73 | CCNK (0.44) | KDM4AKDM5CKDM4CKDM2AKDM3A | |
| SCHEMBL10072164 | 0.70 | KDM4A (0.44) | KDM4AKDM5CKDM4CKDM2AKDM3A | |
| SCHEMBL719766 | 0.68 | KDR (0.49) | EGLN1EPHB4TEKKDRCDC7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2663566-B1 | 5-([1,2,3]TRIAZOLE-4-YL)-7H-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2015-06-03 | — | — | EP | disclosed |
| EP-2663566-A1 | 5-([1,2,3]TRIAZOLE-4-YL)-7H-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES | Merck Patent GmbH (DE) | 2013-11-20 | — | — | EP | disclosed |
| WO-2012095142-A1 | 5-([1,2,3]TRIAZOLE-4-YL)-7H-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 2012-07-19 | — | — | WO | disclosed |