Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 5/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HRH1 | P35367 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27210235 | 0.86 | SLC1A1 (0.49) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL11587569 | 0.85 | BIRC2 (0.49) | SLC1A1TSHRCA2CA1CA12 | |
| SCHEMBL579709 | 0.84 | CA1 (0.50) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL11516810 | 0.84 | TSHR (0.52) | SLC1A1TSHRMGAMGAASI | |
| SCHEMBL27210228 | 0.82 | HDAC7 (0.48) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL9766489 | 0.80 | HDAC1 (0.60) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL28193296 | 0.79 | HDAC7 (0.48) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| Ammonia Solution, Strong SCHEMBL27769629 | 0.78 | HDAC1 (0.57) | SLC1A1HDAC7HDAC8HDAC6HDAC9 | |
| SCHEMBL11586967 | 0.77 | HDAC1 (0.52) | HDAC7HDAC8HDAC6HDAC9HDAC5 | |
| SCHEMBL7784246 | 0.76 | L3MBTL1 (0.40) | SLC1A1TSHRCA2CA1CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4431848-A | Preparation of resorcinol and substituted resorcinols by liquid-phase dehydrogenation of 1,3-cyclic diones derived by vapor-phase cyclization of delta-keto carboxylic acid esters | KOPPERS COMPANY, INC. (US) | 1984-02-14 | — | — | US | disclosed |
| US-4399310-A | Preparation of 1,3-cyclic diones by vapor phase cyclization of delta-keto carboxylic acid esters utilizing carrier condensable under ambient conditions | KOPPERS COMPANY, INC. (US) | 1983-08-16 | — | — | US | disclosed |