Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 2/20 | 0.38 |
| ▸ | CDK8 | P49336 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | LPO | P22079 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5265171 | 0.77 | HTR2C (0.42) | CCNCCDK8BRD4HTR2CHTR2A | |
| SCHEMBL6141148 | 0.77 | HTR2C (0.36) | CCNCCDK8BRD4HTR2CHTR2A | |
| SCHEMBL197434 | 0.77 | HTR2C (0.47) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7173179 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7175653 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7171164 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7172386 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7179318 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| Hydrochloric Acid SCHEMBL7176249 | 0.76 | HTR2C (0.46) | CCNCCDK8BRD4HTR2CHTR2A | |
| SCHEMBL24575964 | 0.74 | MYC (0.40) | CCNCCDK8BRD4HTR2CHTR2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015188777-A1 | CERTAIN PROTEIN KINASE INHIBITORS | SHANGHAI FOCHON PHARMACEUTICAL CO LTD (CN) | 2015-12-17 | — | — | WO | disclosed |