Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | GSK3B | P49841 | 2/20 | 0.44 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | APAF1 | O14727 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10894828 | 0.86 | CES2 (0.46) | CES2CES1GSK3BSRD5A2PTPN1 | |
| SCHEMBL10896584 | 0.84 | CES2 (0.43) | CES2CES1GSK3BSRD5A2PTPN1 | |
| SCHEMBL10895274 | 0.82 | CES2 (0.46) | CES2CES1GSK3BSRD5A2PTPN1 | |
| SCHEMBL9069999 | 0.81 | CES2 (0.70) | CES2CES1GSK3BSRD5A2PTPN1 | |
| SCHEMBL10910878 | 0.77 | CES2 (0.37) | CES2CES1GSK3BSRD5A2PTPN1 | |
| SCHEMBL102601 | 0.77 | TSHR (0.47) | CES2CES1SRD5A2HPGDTSHR | |
| SCHEMBL4204801 | 0.77 | PDE2A (0.36) | CES2CES1GSK3BTSHR | |
| SCHEMBL23390997 | 0.74 | HDAC1 (0.59) | SRD5A2KMT2AMEN1HPGDTRPV1 | |
| Hydrochloric Acid SCHEMBL8577339 | 0.74 | PDE2A (0.35) | CES2CES1GSK3BTSHR | |
| Hydrochloric Acid SCHEMBL8577343 | 0.74 | PDE2A (0.35) | CES2CES1GSK3BTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0293747-A2 | Process for the preparation of fluoride-substituted carboxylic-acid chlorides | BASF Aktiengesellschaft (DE) | 1988-12-07 | — | — | EP | disclosed |