Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 6/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | PADI4 | Q9UM07 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10314232 | 1.00 | DPP4 (0.43) | DPP4KCNH2PADI4CHRM1CHRM2 | |
| SCHEMBL10314234 | 1.00 | DPP4 (0.43) | DPP4KCNH2PADI4CHRM1CHRM2 | |
| Hydrochloric Acid SCHEMBL1062646 | 0.99 | DPP4 (0.42) | DPP4KCNH2PADI4CHRM1CHRM2 | |
| Hydrochloric Acid SCHEMBL1061118 | 0.99 | DPP4 (0.42) | DPP4KCNH2PADI4CHRM1CHRM2 | |
| SCHEMBL10314231 | 0.95 | SMN1; SMN2 (0.42) | DPP4KCNH2CHRM1 | |
| Hydrochloric Acid SCHEMBL1055344 | 0.94 | SMN1; SMN2 (0.42) | DPP4KCNH2CHRM1 | |
| SCHEMBL10314233 | 0.91 | ALDH1A1 (0.40) | — | |
| SCHEMBL10314493 | 0.90 | SMN1; SMN2 (0.43) | — | |
| Hydrochloric Acid SCHEMBL1056923 | 0.90 | ALDH1A1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL1079829 | 0.90 | SMN1; SMN2 (0.43) | — |
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-2247588-B1 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2016-04-13 | — | — | EP | disclosed |