Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 6/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8515283 | 1.00 | ADRB2 (0.36) | ADRB2CYP3A4HSD17B10ADRA2AADRA2B | |
| SCHEMBL14981225 | 0.77 | DPP4 (0.35) | ADRB2CYP3A4HSD17B10ADRA2AADRA2B | |
| SCHEMBL8514447 | 0.77 | PSEN1 (0.43) | ADRA2CADRA1ADPP4 | |
| SCHEMBL4876509 | 0.77 | CES2 (0.43) | ADRB2CYP3A4HSD17B10ADRA2AADRA2B | |
| SCHEMBL8513268 | 0.77 | CES2 (0.43) | ADRB2CYP3A4HSD17B10ADRA2AADRA2B | |
| SCHEMBL8514443 | 0.77 | PSEN1 (0.43) | ADRA2CADRA1ADPP4 | |
| Hydrochloric Acid SCHEMBL1440962 | 0.75 | IDO1 (0.44) | CYP3A4DPP4KDM4EMAPTAPEX1 | |
| Hydrochloric Acid SCHEMBL1440966 | 0.75 | IDO1 (0.44) | CYP3A4DPP4KDM4EMAPTAPEX1 | |
| SCHEMBL28246724 | 0.74 | DPP4 (0.37) | ADRB2CYP3A4HSD17B10ADRA2AADRA2B | |
| SCHEMBL4597897 | 0.74 | ADRA2C (0.36) | HSD17B10ADRA2AADRA2BADRA2CADRA1A |
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-103228649-B | Quinazoline methane amide azetidine | MERCK PATENT GMBH (DE) | 2015-11-25 | — | — | CN | disclosed |