Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | PDE2A | O00408 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.36 |
| ▸ | IGFBP3 | P17936 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11491038 | 0.85 | CES2 (0.46) | CES2ALDH1A1BRD4 | |
| SCHEMBL11483551 | 0.82 | PKM (0.41) | PTGDR2ALDH1A1TDP1GAAPKM | |
| SCHEMBL11483998 | 0.76 | PKM (0.39) | ALDH1A1TDP1GAAPKMTSHR | |
| SCHEMBL11483657 | 0.76 | KMO (0.41) | ALDH1A1AKR1C3AKR1C2GAAPKM | |
| SCHEMBL11488916 | 0.73 | ADRA1D (0.47) | ALDH1A1TDP1GAAPKMTSHR | |
| SCHEMBL31002588 | 0.72 | GPBAR1 (0.43) | ALDH1A1TDP1 | |
| SCHEMBL23212270 | 0.71 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRBRD4 | |
| SCHEMBL21298733 | 0.71 | ALDH1A1 (0.52) | ALDH1A1TDP1TSHRBRD4 | |
| SCHEMBL11484432 | 0.70 | PKM (0.69) | ALDH1A1GAAPKMTSHRSRD5A2 | |
| SCHEMBL16166195 | 0.70 | PDE2A (0.42) | CES2CES1PTGDR2PDE2AALDH1A1 |
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-4185992-A | Imidazole derivatives | MAY & BAKER LIMITED (GB) | 1980-01-29 | — | — | US | disclosed |