Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 11/20 | 0.35 |
| ▸ | CES1 | P23141 | 6/20 | 0.35 |
| ▸ | CES2 | O00748 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL5310917 | 0.86 | FAAH (0.39) | ALDH1A1L3MBTL1CA1CA2CA12 | |
| Trifluoroacetic Acid SCHEMBL34466006 | 0.84 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CA1CA2CA12 | |
| Trifluoroacetic Acid SCHEMBL3845260 | 0.83 | CA1 (0.47) | ALDH1A1L3MBTL1CA1CA2CA12 | |
| Trifluoroacetic Acid SCHEMBL30657138 | 0.83 | CA1 (0.47) | ALDH1A1L3MBTL1CA1CA2CA12 | |
| Trifluoroacetic Acid SCHEMBL30605511 | 0.83 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1CA1CA2CA12 | |
| Trifluoroacetic Acid SCHEMBL18246400 | 0.83 | FAAH (0.44) | CA2FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL27903040 | 0.81 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1FAAHCES1CES2 | |
| Trifluoroacetic Acid SCHEMBL17258930 | 0.81 | FAAH (0.51) | CA2FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL359979 | 0.80 | FAAH (0.39) | ALDH1A1FAAHCES1CES2MEN1 | |
| Trifluoroacetic Acid SCHEMBL6224514 | 0.80 | FAAH (0.39) | ALDH1A1FAAHCES1CES2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025081019-A1 | KIF MODULATOR COMPOUNDS AND METHODS OF USE | IAMBIC THERAPEUTICS, INC. (US) | 2025-04-17 | — | — | WO | disclosed |
| CN-117964541-A | Pyrrole sulfonyl derivative, and preparation method and application thereof | 天地恒一制药股份有限公司 | 2024-05-03 | — | — | CN | disclosed |
| CN-108137545-A | TRIAZOLE AGONISTS OF THE APJ RECEPTOR | 美国安进公司 | 2018-06-08 | — | — | CN | disclosed |