Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.56 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | FABP7 | O15540 | 1/20 | 0.40 |
| ▸ | FABP3 | P05413 | 1/20 | 0.40 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL135105 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL197791 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL1226045 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL8513273 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL197425 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL135106 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL5696388 | 0.87 | KCNH2 (0.56) | KCNH2SCN3ADPP4CYP2C19S1PR4 | |
| SCHEMBL14635593 | 0.86 | KCNH2 (0.52) | KCNH2SCN3ADPP4SLC6A3 | |
| SCHEMBL14635594 | 0.86 | KCNH2 (0.52) | KCNH2SCN3ADPP4SLC6A3 | |
| Hydrochloric Acid SCHEMBL5513962 | 0.85 | KCNH2 (0.55) | KCNH2SCN3ADPP4CYP2C19S1PR4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2513053-A1 | PYRROLIDINE OR THIAZOLIDINE CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERSAS AS AGONISTS OF G- PROTEIN COUPLED RECEPTOR 43 (GPR43) | Euroscreen S.A. (BE) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011073376-A1 | PYRROLIDINE OR THIAZOLIDINE CARBOXYLIC ACID DERIVATIVES, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERSAS AS AGONISTS OF G- PROTEIN COUPLED RECEPTOR 43 (GPR43) | EUROSCREEN S.A. (BE) | 2011-06-23 | — | — | WO | disclosed |