Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.59 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.59 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12165674 | 0.74 | ADORA2A (0.89) | ADORA2AADORA1PTPN1MAOAMAOB | |
| SCHEMBL11823273 | 0.69 | ALDH1A1 (0.50) | ADORA2AADORA1PTPN1LMNAMEN1 | |
| SCHEMBL11195391 | 0.68 | ADORA2A (0.43) | ADORA2AADORA1PTPN1LMNAMEN1 | |
| SCHEMBL3207917 | 0.67 | TLR8 (0.57) | LMNAKMT2AALDH1A1MAPTKDM4E | |
| SCHEMBL10575256 | 0.67 | BCL2 (0.48) | CYP3A4 | |
| SCHEMBL14478942 | 0.66 | KDM4E (0.50) | ADORA2AADORA1NPSR1CYP1A2CYP3A4 | |
| SCHEMBL9409256 | 0.66 | LTB4R (0.45) | ADORA2AADORA1 | |
| SCHEMBL12165801 | 0.66 | ADORA2A (0.67) | ADORA2AADORA1PTPN1MAOAMAOB | |
| SCHEMBL21223649 | 0.66 | CYP3A4 (0.46) | ADORA1LMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL22633448 | 0.65 | RAD51 (0.45) | ADORA2AADORA1PTPN1SMN1; SMN2NPSR1 |
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-114423763-B | Regioselective synthesis of imidazo [1,2-a ] pyrimidines | 豪夫迈·罗氏有限公司 | 2025-01-21 | — | — | CN | disclosed |