Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 11/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | HTR7 | P34969 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CDK7 | P50613 | 7/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.40 |
| ▸ | CDK9 | P50750 | 3/20 | 0.40 |
| ▸ | CCNH | P51946 | 3/20 | 0.40 |
| ▸ | MNAT1 | P51948 | 3/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CCNK | O75909 | 1/20 | 0.37 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.37 |
| ▸ | CDK12 | Q9NYV4 | 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 | |
|---|---|---|---|---|
| SCHEMBL28349390 | 1.00 | HTR6 (0.41) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL28346025 | 0.91 | CDK7 (0.49) | HTR6CDK7CCNT1CDK9CCNH | |
| SCHEMBL28348918 | 0.91 | CDK7 (0.46) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL28348915 | 0.91 | CDK7 (0.46) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL28346026 | 0.91 | CDK7 (0.49) | HTR6CDK7CCNT1CDK9CCNH | |
| SCHEMBL18047298 | 0.87 | HTR6 (0.45) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL18047299 | 0.87 | HTR6 (0.45) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL28346623 | 0.87 | HTR6 (0.45) | HTR6DRD2HTR2AHTR7HTR1A | |
| Hydrochloric Acid SCHEMBL18047342 | 0.86 | HTR6 (0.47) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL17688362 | 0.84 | HTR6 (0.41) | HTR6DRD2HTR2AHTR7HTR1A |
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-105849099-B | Polycyclic inhibitors of cyclin dependent kinase 7(CDK7) | 达纳-法伯癌症研究所股份有限公司 | 2020-01-17 | — | — | CN | disclosed |