Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 3/20 | 0.47 |
| ▸ | NT5E | P21589 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 6/20 | 0.43 |
| ▸ | DPP4 | P27487 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TACR3 | P29371 | 2/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4435275 | 0.88 | NT5E (0.44) | ADORA2ANT5EDPP4MAPK1USP2 | |
| SCHEMBL4441914 | 0.79 | SMN1; SMN2 (0.51) | ADORA2ANT5EMAPK1USP2CYP1A2 | |
| SCHEMBL19331478 | 0.79 | TAAR1 (0.47) | ADORA2ATAAR1DPP4MAPK1USP2 | |
| SCHEMBL2015151 | 0.79 | SYK (0.45) | ADORA2ATAAR1DPP4USP2CYP1A2 | |
| SCHEMBL4437114 | 0.75 | MAP4K4 (0.41) | ADORA2ATAAR1MAPK1USP2CYP1A2 | |
| SCHEMBL4174797 | 0.75 | NT5E (0.50) | ADORA2ANT5EMAPK1USP2CYP1A2 | |
| SCHEMBL4178011 | 0.75 | ADORA2A (0.47) | ADORA2ANT5EDPP4CYP1A2CYP3A4 | |
| SCHEMBL4434943 | 0.75 | NPC1 (0.41) | ADORA2ATAAR1DPP4KMT2AADORA1 | |
| SCHEMBL4437511 | 0.75 | TAAR1 (0.43) | ADORA2ANT5ETAAR1DPP4MAPK1 | |
| SCHEMBL2717755 | 0.74 | NT5E (0.46) | ADORA2ANT5ETAAR1DPP4MEN1 |
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-2137186-A1 | HETEROCYCLIC COMPOUNDS AND THEIR USES | Amgen Inc. (US) | 2009-12-30 | — | — | EP | disclosed |
| WO-2008118468-A1 | HETEROCYCLIC COMPOUNDS AND THEIR USES | AMGEN INC. (US) | 2008-10-02 | — | — | WO | disclosed |