Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CES1 | P23141 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.38 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NAAA | Q02083 | 1/20 | 0.32 |
| ▸ | DGKA | P23743 | 1/20 | 0.32 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.32 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | BCL9 | O00512 | 1/20 | 0.32 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28541873 | 0.98 | ALDH1A1 (0.64) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL6426591 | 0.87 | ALDH1A1 (0.46) | ALDH1A1CES1TDP1TSHRLMNA | |
| SCHEMBL28743098 | 0.84 | DGKA (0.52) | ALDH1A1CES1CES2TDP1TSHR | |
| SCHEMBL9276995 | 0.82 | DGKA (0.55) | ALDH1A1CES1CES2TDP1TSHR | |
| SCHEMBL777608 | 0.81 | ALDH1A1 (0.42) | ALDH1A1CES1FFAR3TDP1TSHR | |
| SCHEMBL766145 | 0.81 | ALDH1A1 (0.61) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL30568759 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL8158 | 0.81 | ALDH1A1 (1.00) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL19810344 | 0.80 | ALDH1A1 (0.67) | ALDH1A1CES1CES2HDAC3HDAC1 | |
| SCHEMBL6934724 | 0.80 | ALDH1A1 (0.67) | ALDH1A1CES1CES2HDAC3HDAC1 |
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-11688519-B2 | Method and system for monitoring the gut health of an individual | TATA CONSULTANCY SERVICES LIMITED (IN) | 2023-06-27 | — | — | US | disclosed |
| US-4317843-A | PSEUDOMONAS AS FOOD | IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) | 1982-03-02 | — | — | US | disclosed |