Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CACNA1G | O43497 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28844153 | 0.85 | SIGMAR1 (0.40) | SIGMAR1POLBSMN1; SMN2LMNAHTR1A | |
| SCHEMBL28145812 | 0.82 | KDM4E (0.58) | HTR1AHTR2CMEN1KMT2AMAPT | |
| SCHEMBL28145820 | 0.82 | LMNA (0.51) | LMNAMEN1KMT2AMAPTHTT | |
| SCHEMBL28145836 | 0.82 | PRMT6 (0.47) | LMNAMEN1KMT2AMAPTHTT | |
| SCHEMBL28144823 | 0.78 | OPRK1 (0.43) | LMNAMEN1KMT2AKCNH2MAPT | |
| SCHEMBL28145787 | 0.78 | ALDH1A1 (0.54) | LMNAMEN1KMT2AMAPTHTT | |
| SCHEMBL28144828 | 0.78 | KDM4E (0.56) | POLBMEN1KMT2ACYP1A2HTT | |
| SCHEMBL28144854 | 0.77 | HRH3 (0.47) | MEN1KMT2AROCK2 | |
| SCHEMBL28144851 | 0.77 | PRMT6 (0.56) | SIGMAR1LMNAMEN1KMT2AMAPT | |
| SCHEMBL10860653 | 0.76 | SIGMAR1 (0.54) | SIGMAR1POLBSMN1; SMN2LMNAHTR1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-106659715-A | substituted aminotriazoles and methods of use thereof | 药物发现研究所 | 2017-05-10 | — | — | CN | claimed |
| CN-106659715-A | substituted aminotriazoles and methods of use thereof | 药物发现研究所 | 2017-05-10 | — | — | CN | disclosed |