Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.47 |
| ▸ | RXRB | P28702 | 1/20 | 0.47 |
| ▸ | RXRG | P48443 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | THRA | P10827 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14441580 | 0.88 | RXRA (0.56) | RXRARXRBRXRGKDM4EKMT2A | |
| Trifluoroacetic Acid SCHEMBL30151164 | 0.85 | TACR1 (0.40) | PPARAFFAR4FFAR1PPARDALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL30151168 | 0.85 | CYP3A4 (0.41) | RXRARXRBRXRGPPARAFFAR4 | |
| SCHEMBL4974901 | 0.84 | TACR1 (0.43) | — | |
| Trifluoroacetic Acid SCHEMBL30151192 | 0.84 | THRA (0.40) | KMT2AMEN1PPARAFFAR4FFAR1 | |
| Trifluoroacetic Acid SCHEMBL30151186 | 0.84 | PPARA (0.38) | PPARAFFAR4FFAR1PPARDALDH1A1 | |
| Hydrochloric Acid SCHEMBL4974896 | 0.83 | IDO1 (0.43) | — | |
| SCHEMBL5884605 | 0.80 | KMT2A (0.51) | KDM4EKMT2AMEN1ALDH1A1HTT | |
| SCHEMBL3932054 | 0.79 | CYP3A4 (0.44) | RXRARXRBRXRGPPARAFFAR4 | |
| Trifluoroacetic Acid SCHEMBL30151162 | 0.79 | FFAR1 (0.56) | PPARAFFAR4FFAR1PPARDHDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115551846-B | 1,4,5, 6-tetrahydropyrimidin-2-amine derivatives | ＵＢＥ株式会社 | 2024-03-08 | — | — | CN | disclosed |
| CN-115551846-A | 1,4,5,6-tetrahydropyrimidin-2-amine derivatives | ＵＢＥ株式会社 | 2022-12-30 | — | — | CN | disclosed |