Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | EEF2K | O00418 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27121057 | 0.88 | PDPK1 (0.37) | PDPK1LOXL2ADORA1ADORA2AADRB2 | |
| SCHEMBL277115 | 0.73 | GSTP1 (0.37) | CYP2A6 | |
| SCHEMBL4276909 | 0.68 | GABRA1 (0.38) | PDPK1LOXL2ADORA1ADORA2AADRB2 | |
| SCHEMBL497629 | 0.68 | PDPK1 (0.45) | PDPK1LOXL2ADORA1ADORA2AADRB2 | |
| SCHEMBL11502520 | 0.66 | MAPT (0.41) | CYP2A6 | |
| SCHEMBL1606338 | 0.66 | PDPK1 (0.43) | PDPK1LOXL2ADORA1ADORA2AADRB2 | |
| SCHEMBL2052306 | 0.66 | PDPK1 (0.36) | PDPK1LOXL2ADORA1ADORA2AADRB2 | |
| SCHEMBL10802875 | 0.65 | MAPT (0.37) | — | |
| SCHEMBL11883529 | 0.65 | TYMP (0.40) | — | |
| SCHEMBL5810324 | 0.65 | PDPK1 (0.42) | PDPK1LOXL2ADORA1ADORA2AADRB2 |
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-2513098-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011075515-A1 | AMINOPYRIMIDINES AS SYK INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-06-23 | — | — | WO | disclosed |