Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | PTK2B | Q14289 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.45 |
| ▸ | HTR3A | P46098 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | MELK | Q14680 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29664444 | 0.89 | MAPT (0.58) | GAAKMT2AADRA2CKDM4EMAPT | |
| SCHEMBL521324 | 0.89 | MAPT (0.58) | GAAKMT2AADRA2CKDM4EMAPT | |
| SCHEMBL2821413 | 0.83 | MAPT (0.51) | GAAKMT2AADRA2CKDM4EMAPT | |
| 2-Aminopyridine SCHEMBL28293021 | 0.80 | AURKA (0.46) | ADRA2CALDH1A1CYP1A2PIK3CAMTOR | |
| SCHEMBL28051294 | 0.77 | RPS6KA3 (0.59) | GAAKMT2AADRA2CKDM4EMAPT | |
| SCHEMBL23126541 | 0.76 | PIK3CA (0.53) | GAAKMT2AADRA2CKDM4EMAPT | |
| SCHEMBL22495367 | 0.76 | PLD1 (0.50) | KMT2AKDM4EMAPTALDH1A1KCNH2 | |
| SCHEMBL10126764 | 0.75 | ACVR1 (0.53) | PIK3CAMTOR | |
| SCHEMBL732444 | 0.74 | CHRNB2 (0.59) | ALDH1A1CYP1A2 | |
| SCHEMBL30199895 | 0.74 | CHRNB2 (0.59) | ALDH1A1CYP1A2 |
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-109789143-A | Antiproliferative based on pyrimidine | G1治疗公司 | 2019-05-21 | — | — | CN | disclosed |