Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 4/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.41 |
| ▸ | CDK9 | P50750 | 3/20 | 0.41 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4729310 | 0.86 | CCNC (0.37) | NTRK1CCNT1CDK9GRM5CDK2 | |
| SCHEMBL4779882 | 0.85 | TRPV3 (0.45) | NTRK1CCNCCDK8TRPV1 | |
| SCHEMBL4780128 | 0.84 | CCNT1 (0.43) | NTRK1CCNT1CDK9CDK2CCNC | |
| SCHEMBL4725583 | 0.78 | CCNT1 (0.41) | CCNT1CDK9TRPV1MAPK1LMNA | |
| SCHEMBL14670569 | 0.77 | NTRK1 (0.58) | NTRK1CCNT1CDK9CDK2CCNC | |
| SCHEMBL4619629 | 0.77 | NTRK1 (0.58) | NTRK1CCNT1CDK9CDK2CCNC | |
| SCHEMBL4728071 | 0.76 | USP1 (0.46) | CCNT1CDK9CDK2CCNCCDK8 | |
| SCHEMBL4727785 | 0.76 | CCNT1 (0.46) | CCNT1CDK9TRPV1MAPK1 | |
| SCHEMBL4729366 | 0.75 | SLC10A1 (0.36) | CDK2CCNCCDK8MAPK1LMNA | |
| SCHEMBL20575316 | 0.75 | NTRK1 (0.44) | NTRK1CCNT1CDK9CDK2CCNC |
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-101218229-A | Pyrazolyl-amino-substituted pyrimidines and their use in the treatment of cancer | ASTRAZENECA AB (SE) | 2008-07-09 | — | — | CN | disclosed |