Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.49 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | VDR | P11473 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9550494 | 0.89 | NTRK1 (0.53) | CYP1A2CYP1A1CYP1B1ALDH1A1HPGD | |
| SCHEMBL9550442 | 0.88 | MAOA (0.51) | HDAC6ALDH1A1HPGDKDM4EMAOB | |
| SCHEMBL5124787 | 0.78 | GPR35 (0.56) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9550378 | 0.75 | RAB9A (0.67) | ALDH1A1HPGDKDM4ESMN1; SMN2RECQL | |
| SCHEMBL18224256 | 0.74 | VDR (0.50) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9550422 | 0.74 | CYP1A1 (0.54) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL11730948 | 0.73 | NTRK1 (0.56) | CYP1A2CYP1A1CYP1B1ALDH1A1HPGD | |
| SCHEMBL9367517 | 0.73 | HDAC3 (0.47) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL9550475 | 0.72 | MAOA (0.54) | HDAC6CYP1A2CYP1A1CYP1B1ALDH1A1 | |
| SCHEMBL4382035 | 0.72 | HDAC4 (0.46) | HDAC8ALDH1A1HPGDKDM4EESR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5182295-A | Miticides, fungicides | ROUSSEL UCLAF (FR) | 1993-01-26 | — | — | US | disclosed |