Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.49 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL28167332 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11678413 | 0.98 | ALDH1A1 (0.54) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11678306 | 0.82 | KCNH2 (0.48) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11862034 | 0.81 | SIGMAR1 (0.47) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| SCHEMBL11678333 | 0.81 | KCNH2 (0.50) | ALDH1A1TSHRATMNPSR1KCNH2 | |
| SCHEMBL11797763 | 0.81 | SIGMAR1 (0.47) | ALDH1A1TSHRATMNPSR1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL11780293 | 0.81 | KCNH2 (0.47) | ALDH1A1TSHRATMNPSR1KCNH2 | |
| SCHEMBL31228811 | 0.80 | HTR2A (0.52) | ALDH1A1SLC6A4TP53HTR2A | |
| SCHEMBL2930325 | 0.80 | HTR2A (0.52) | ALDH1A1SLC6A4TP53HTR2A | |
| Hydrochloric Acid SCHEMBL11862820 | 0.80 | SIGMAR1 (0.46) | ALDH1A1TSHRATMNPSR1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3983124-A | ANTIVIRAL AGENTS | RICHARDSON-MERRELL INC. (US) | 1976-09-28 | — | — | US | disclosed |