Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9419140 | 0.80 | LMNA (0.44) | ALDH1A1MAPTLMNAPOLBTP53 | |
| SCHEMBL9516465 | 0.77 | HCRTR1 (0.42) | ALDH1A1MAPTLMNATP53KDM4E | |
| SCHEMBL4592687 | 0.71 | MEN1 (0.41) | ALDH1A1MAPTLMNAKDM4ETSHR | |
| SCHEMBL19384332 | 0.71 | TP53 (0.43) | ALDH1A1LMNATP53TSHRMEN1 | |
| SCHEMBL341786 | 0.70 | ALDH1A1 (0.61) | ALDH1A1MAPTHTTTP53KDM4E | |
| SCHEMBL29063387 | 0.70 | CYP1A2 (0.38) | ALDH1A1POLBHTTKDM4ENPSR1 | |
| Hydrochloric Acid SCHEMBL8378178 | 0.69 | NPSR1 (0.41) | ALDH1A1MAPTLMNAPOLBHTT | |
| SCHEMBL2754161 | 0.68 | TP53 (0.46) | ALDH1A1LMNATP53TSHRMEN1 | |
| SCHEMBL11589439 | 0.68 | ALDH1A1 (0.47) | ALDH1A1LMNAHTTTP53TSHR | |
| SCHEMBL13090981 | 0.67 | ALDH1A1 (0.47) | ALDH1A1MAPTLMNAPOLBTP53 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0410726-B1 | S-SUBSTITUTED BETA-THIOACRYLAMIDES AND THEIR USE AS MICROBICIDES | ROHM AND HAAS COMPANY (US) | 1993-09-01 | — | — | EP | disclosed |
| US-5118681-A | Bactericides | ROHM AND HAAS COMPANY (US) | 1992-06-02 | — | — | US | disclosed |
| EP-0410726-A1 | S-substituted beta-thioacrylamides and their use as microbicides | ROHM AND HAAS COMPANY (US) | 1991-01-30 | — | — | EP | disclosed |