Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 1/20 | 0.55 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.51 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | AXL | P30530 | 1/20 | 0.45 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 2/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 1/20 | 0.40 |
| ▸ | CDC7 | O00311 | 3/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.39 |
| ▸ | TET1 | Q8NFU7 | 1/20 | 0.39 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1558087 | 0.89 | MAP2K1 (0.55) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL8117757 | 0.81 | ADORA2A (0.49) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL2114977 | 0.80 | ADORA2A (0.67) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| Hydrochloric Acid SCHEMBL10655021 | 0.79 | ADORA2A (0.65) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL11883907 | 0.79 | MAP2K1 (0.61) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL28164021 | 0.77 | MAP2K1 (0.81) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL1115630 | 0.76 | TET2 (0.71) | KMT2ATET2TET1 | |
| SCHEMBL6225557 | 0.76 | MAP2K1 (0.54) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL1820660 | 0.76 | ADORA2A (0.61) | ADORA2AMAP2K1CAMKK2KMT2AAXL | |
| SCHEMBL2511843 | 0.76 | SLC22A6 (0.58) | ADORA2AMAP2K1CAMKK2KMT2AAXL |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3307741-A1 | POSITIVE ALLOSTERIC MODULATORS OF MUSCARINIC M2 RECEPTOR | Bayer Pharma Aktiengesellschaft (DE) | 2018-04-18 | — | — | EP | disclosed |
| WO-2016198342-A1 | POSITIVE ALLOSTERIC MODULATORS OF MUSCARINIC M2 RECEPTOR | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2016-12-15 | — | — | WO | disclosed |