Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | PTPRC | P08575 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.47 |
| ▸ | PAM | P19021 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.38 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| SCHEMBL9723329 | 1.00 | ALDH1A1 (0.50) | ALDH1A1TSHRPTPRCPTPN1PAM | |
| SCHEMBL504013 | 0.79 | ALDH1A1 (0.57) | ALDH1A1TSHRHDAC1CYP2C19L3MBTL1 | |
| SCHEMBL9748549 | 0.79 | ALDH1A1 (0.80) | ALDH1A1TSHRHDAC1CYP2C19HTT | |
| Hydrogen Sulfide SCHEMBL27877649 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TSHRHDAC1CYP2C19L3MBTL1 | |
| Hydrogen Sulfide SCHEMBL28874622 | 0.77 | ALDH1A1 (0.55) | ALDH1A1TSHRHDAC1CYP2C19L3MBTL1 | |
| SCHEMBL8734909 | 0.76 | LMNA (0.51) | ALDH1A1NPC1L3MBTL1MAOBGLA | |
| SCHEMBL3997255 | 0.75 | ALDH1A1 (0.62) | ALDH1A1TSHRPTPRCPTPN1HDAC1 | |
| SCHEMBL1716940 | 0.75 | PAM (0.53) | ALDH1A1TSHRPAMHDAC1CYP2C19 | |
| SCHEMBL3997248 | 0.75 | ALDH1A1 (0.62) | ALDH1A1TSHRPTPRCPTPN1HDAC1 | |
| SCHEMBL1716939 | 0.75 | PAM (0.53) | ALDH1A1TSHRPAMHDAC1CYP2C19 |
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-5089639-A | N-CYCLOALKYLALKYLAMINES, PROCESS FOR THEIR PREPARATION, THEIR USE AS A MEDICAMENT AND THEIR SYNTHESIS INTERMEDIATES | JOUVEINAL S.A. (FR) | 1992-02-18 | — | — | US | disclosed |