Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 4/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16161331 | 0.90 | THRB (0.46) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL19942011 | 0.90 | TP53 (0.62) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL19941727 | 0.90 | TP53 (0.62) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL6862095 | 0.90 | TP53 (0.62) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL4491334 | 0.87 | THRB (0.61) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL4970293 | 0.84 | TP53 (0.57) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL27908674 | 0.83 | THRB (0.61) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL6098104 | 0.83 | EPHX1 (0.46) | TP53ALDH1A1NPSR1SMN1; SMN2TSHR | |
| SCHEMBL6651323 | 0.81 | TP53 (0.54) | TP53ALDH1A1NPSR1SMN1; SMN2KMT2A | |
| SCHEMBL30773006 | 0.81 | ALDH1A1 (0.57) | TP53ALDH1A1NPSR1KMT2ATHRB |
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 |
|---|---|---|---|---|---|---|---|
| US-5194671-A | Process for the preparation of β-ketocarboxylic acid esters | WACKER-CHEMIE GMBH (DE) | 1993-03-16 | — | — | US | claimed |
| US-5198322-A | Positively operating radiation-sensitive mixture containing a polyfunctional α-diazo-β-keto ester and radiation-sensitive recording material containing this mixture | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-03-30 | — | — | US | disclosed |
| US-4996301-A | Polyfunctional α-diazo-β-keto esters and their use in light-sensitive compositions | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-02-26 | — | — | US | disclosed |