Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | THRA | P10827 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11678413 | 1.00 | ALDH1A1 (0.54) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11786146 | 0.98 | ALDH1A1 (0.55) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11678306 | 0.84 | KCNH2 (0.48) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL11780293 | 0.83 | KCNH2 (0.47) | ALDH1A1TSHRATMNPSR1KCNH2 | |
| SCHEMBL11797763 | 0.83 | SIGMAR1 (0.47) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11862034 | 0.83 | SIGMAR1 (0.47) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11678333 | 0.83 | KCNH2 (0.50) | ALDH1A1TSHRATMNPSR1KCNH2 | |
| Hydrochloric Acid SCHEMBL11862820 | 0.81 | SIGMAR1 (0.46) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL4898274 | 0.81 | HTR2A (0.55) | ALDH1A1SLC6A4DRD2SLC6A2HTR2A | |
| SCHEMBL4900272 | 0.81 | HTR2A (0.55) | ALDH1A1SLC6A4DRD2SLC6A2HTR2A |
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-107189041-A | Cross-linking solar cell interface material of one class based on azido derivant | 西安近代化学研究所 | 2017-09-22 | — | — | CN | disclosed |
| CN-107141449-A | Cross-linking solar cell interface material of one class based on azido derivant | 西安近代化学研究所 | 2017-09-08 | — | — | CN | disclosed |