Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.45 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9464267 | 0.92 | HRH3 (0.46) | HRH3DRD3MAPTKDM4EHTT | |
| SCHEMBL9540331 | 0.83 | TDP1 (0.61) | TDP1KMT2ANPC1ALDH1A1LMNA | |
| SCHEMBL27691343 | 0.83 | HRH3 (0.64) | HRH3DRD3MAPTKDM4EHTT | |
| Bromide SCHEMBL9463996 | 0.82 | TDP1 (0.59) | TDP1KMT2ANPC1ALDH1A1LMNA | |
| SCHEMBL4570310 | 0.80 | HRH3 (0.66) | HRH3DRD3MAPTKDM4EHTT | |
| SCHEMBL16606218 | 0.79 | HRH3 (0.59) | HRH3DRD3MAPTKDM4EHTT | |
| SCHEMBL9540428 | 0.78 | PABPC1 (0.54) | MAPTCES2CES1TDP1KMT2A | |
| SCHEMBL9397888 | 0.78 | ESR1 (0.65) | HRH3DRD3MAPTKDM4EHTT | |
| SCHEMBL14369811 | 0.77 | HRH3 (0.58) | HRH3DRD3MAPTKDM4EHTT | |
| SCHEMBL26354039 | 0.77 | HRH3 (0.58) | HRH3DRD3MAPTKDM4EHTT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993002054-A1 | ESTER-CONTAINING QUATERNARY PYRIDINIUM SALTS | EASTMAN KODAK COMPANY (US) | 1993-02-04 | — | — | WO | disclosed |