Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | DPP4 | P27487 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17897247 | 0.84 | KDM4E (0.41) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL17897242 | 0.84 | KDM4E (0.41) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL19003675 | 0.84 | KDM4E (0.41) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL10269322 | 0.74 | CHRNA7 (0.56) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL12662987 | 0.72 | ESR1 (0.52) | CHRNA7DRD2SIGMAR1ADRA2AADRA2B | |
| SCHEMBL13380548 | 0.72 | ESR1 (0.52) | CHRNA7DRD2SIGMAR1ADRA2AADRA2B | |
| SCHEMBL3567530 | 0.72 | ESR1 (0.52) | CHRNA7DRD2SIGMAR1ADRA2AADRA2B | |
| SCHEMBL10438606 | 0.72 | KDM4E (0.43) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL10438605 | 0.72 | KDM4E (0.43) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 | |
| SCHEMBL28851967 | 0.71 | CHRNA7 (0.49) | CHRNA7DRD2SIGMAR1KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2938344-B1 | PIPERAZINE-SUBSTITUTED [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME (US) | 2017-06-21 | — | — | EP | disclosed |