Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | RGS4 | P49798 | 1/20 | 0.34 |
| ▸ | RGS8 | P57771 | 1/20 | 0.34 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11983452 | 0.76 | ALDH1A1 (0.60) | CREBBPMAPTKDM4EALDH1A1POLB | |
| SCHEMBL2614384 | 0.75 | HTT (0.52) | NPC1RAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL15393378 | 0.74 | CREBBP (0.39) | CREBBPMAPTKDM4EALDH1A1POLB | |
| SCHEMBL12217560 | 0.74 | CREBBP (0.42) | CREBBPNPC1RAB9AMAPTKDM4E | |
| SCHEMBL15360158 | 0.74 | MAPT (0.50) | CREBBPMAPTKDM4EALDH1A1POLB | |
| SCHEMBL25153722 | 0.74 | MAP2K2 (0.40) | CREBBPMAPTKDM4EALDH1A1POLB | |
| SCHEMBL12575366 | 0.74 | MAPT (0.43) | CREBBPMAPTKDM4EALDH1A1POLB | |
| SCHEMBL252411 | 0.74 | KMT2A (0.41) | CREBBPNPC1RAB9AMAPTKDM4E | |
| SCHEMBL9950301 | 0.74 | KDM4E (0.40) | CREBBPRAB9AMAPTKDM4EALDH1A1 | |
| SCHEMBL19513362 | 0.74 | MAPT (0.53) | MAPTKDM4EALDH1A1POLBPTGDR2 |
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-2014169845-A2 | 4,5-DIHYDRO-PYRAZOLO [3, 4-C] PYRID-2-ONES, PREPARATION METHOD AND APPLICATION THEREOF | 四川海思科制药有限公司 (CN) | 2014-10-23 | — | — | WO | disclosed |