Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | EEF2K | O00418 | 1/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.31 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.31 |
| ▸ | ECE1 | P42892 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL678451 | 0.96 | PDPK1 (0.36) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL13935681 | 0.89 | PDPK1 (0.38) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL497629 | 0.70 | PDPK1 (0.45) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL1606338 | 0.69 | PDPK1 (0.43) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL2054183 | 0.68 | ADORA2A (0.33) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL5810324 | 0.67 | PDPK1 (0.42) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL4268252 | 0.67 | EEF2K (0.37) | PDPK1SMPD3ADORA1ADORA2AADRB2 | |
| SCHEMBL13920676 | 0.67 | SLC6A4 (0.40) | SMPD3ADORA1ADORA2AMEN1HPGD | |
| SCHEMBL102331 | 0.66 | PDPK1 (0.59) | PDPK1LOXL2SMPD3ADORA1ADORA2A | |
| SCHEMBL2052309 | 0.66 | PDPK1 (0.34) | 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 |