Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 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 | |
|---|---|---|---|---|
| SCHEMBL7752962 | 0.81 | AR (0.45) | LTB4R2HDAC3HDAC1HDAC2HTR2A | |
| SCHEMBL21169213 | 0.77 | CETP (0.47) | LTB4R2HTR2AHTR2CHTR2BTSHR | |
| SCHEMBL253120 | 0.75 | NPC1 (0.47) | — | |
| SCHEMBL19265466 | 0.74 | HTR7 (0.43) | LTB4R2HTR2AHTR2CHTR2BTSHR | |
| SCHEMBL5500471 | 0.74 | CYP3A4 (0.44) | LTB4R2HTR2AHTR2CHTR2BTSHR | |
| SCHEMBL11265336 | 0.74 | LTB4R2 (0.43) | LTB4R2HDAC3HDAC1HDAC2EPHX1 | |
| SCHEMBL23072505 | 0.74 | TAAR1 (0.46) | HTR2AHTR2CHTR2BTSHRMAPK1 | |
| SCHEMBL8626864 | 0.73 | CYP3A4 (0.55) | HTR2AHTR2CHTR2BTSHRMAPK1 | |
| SCHEMBL6477185 | 0.73 | NPC1 (0.50) | — | |
| SCHEMBL6488829 | 0.73 | NPC1 (0.50) | — |
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-106660962-A | Arylhydrazides containing 2-pyridone moieties for use as selective antibacterial agents | ABAC治疗法有限公司 | 2017-05-10 | — | — | CN | claimed |