Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.48 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | PKLR | P30613 | 1/20 | 0.39 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ALB | P02768 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27534125 | 0.90 | CES2 (0.46) | CES2CES1BCHEPKMPKLR | |
| Benzene SCHEMBL6008819 | 0.85 | CES2 (0.44) | CES2CES1BCHEKAT6AALDH1A1 | |
| SCHEMBL5063676 | 0.84 | CES2 (0.48) | CES2CES1BCHEALDH1A1LMNA | |
| SCHEMBL5065262 | 0.84 | ALDH1A1 (0.46) | CES2CES1ALDH1A1ALOX15LMNA | |
| SCHEMBL27591829 | 0.81 | CES2 (0.45) | CES2CES1BCHEPKMPKLR | |
| Vinylsulfonic Acid SCHEMBL27995919 | 0.79 | CES2 (0.43) | CES2CES1BCHEPKMPKLR | |
| Sulfamide SCHEMBL27721414 | 0.79 | PTGES2 (0.47) | CES2CES1BCHEPKMPKLR | |
| SCHEMBL180426 | 0.78 | — | — | |
| SCHEMBL1515862 | 0.76 | PTGES2 (0.46) | CES2CES1BCHEPKMPKLR | |
| SCHEMBL10786283 | 0.76 | MEN1 (0.40) | CES2CES1ALDH1A1ALOX15LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080090972-A1 | Oligomers and Polymers Containing Sulfinate Groups, and Methods for Producing the Same | KERRES JOCHEN | 2008-04-17 | — | — | US | disclosed |
| US-7288599-B2 | Oligomers and polymers containing sulfinate groups, and method for producing the same | KERRES JOCHEN | 2007-10-30 | — | — | US | disclosed |
| US-20050165172-A1 | Oligomers and polymers containing sulfinate groups, and method for producing the same | KERRES JOCHEN (DE) | 2005-07-28 | — | — | US | disclosed |