Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 12/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 11/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 10/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | KDM6B | O15054 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | KDM5C | P41229 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL21236762 | 0.88 | ADORA3 (0.43) | ADORA2AADORA1ADORA3ADORA2BKDM4E | |
| SCHEMBL16578613 | 0.74 | ADORA2A (0.46) | ADORA2AADORA1ADORA3HDAC2ADORA2B | |
| SCHEMBL3467509 | 0.72 | ADORA2A (0.47) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL23005604 | 0.72 | MEN1 (0.53) | ADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL1875570 | 0.72 | KMT2A (0.48) | ADORA2AADORA1ADORA3 | |
| SCHEMBL12671226 | 0.72 | MEN1 (0.50) | ADORA2AADORA1ADORA3KDM4EKDM6B | |
| SCHEMBL21224988 | 0.71 | KMT2A (0.47) | ADORA2AADORA1ADORA3 | |
| SCHEMBL21225118 | 0.71 | KMT2A (0.47) | ADORA2AADORA1ADORA3 | |
| SCHEMBL21225109 | 0.71 | KMT2A (0.47) | ADORA2AADORA1ADORA3 | |
| SCHEMBL17023211 | 0.71 | ADORA3 (0.37) | ADORA2AADORA1ADORA3KDM4EKDM6B |
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-2019152546-A2 | SALT FORMS OF ORGANIC COMPOUND | KAINOS MEDICINE INC. (KR) | 2019-08-08 | — | — | WO | disclosed |