Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.54 |
| ▸ | CCR3 | P51677 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | OXTR | P30559 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | ACACA | Q13085 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3383896 | 0.92 | OXTR (0.48) | OXTRACHEKDM4EALDH1A1KMT2A | |
| SCHEMBL3387941 | 0.89 | MAPK14 (0.53) | MAPK14CCR3CHRM2OXTRACHE | |
| SCHEMBL3387677 | 0.87 | MAPK14 (0.56) | MAPK14CCR3CHRM2ACHEHTR4 | |
| SCHEMBL3388485 | 0.85 | MAPK14 (0.56) | MAPK14CCR3CHRM2ACHEHTR4 | |
| SCHEMBL3383892 | 0.82 | MAPK14 (0.64) | MAPK14CCR3CHRM2ACHEHTR4 | |
| SCHEMBL3943261 | 0.81 | HRH3 (0.57) | ACHEKDM4EALDH1A1KMT2APOLB | |
| SCHEMBL3390277 | 0.80 | MAPK14 (0.60) | MAPK14CCR3CHRM2OXTRACHE | |
| SCHEMBL3387892 | 0.80 | OXTR (0.47) | OXTRACHEKDM4EHRH3 | |
| SCHEMBL3388617 | 0.80 | DRD2 (0.52) | MAPK14CCR3CHRM2KDM4EALDH1A1 | |
| SCHEMBL3388657 | 0.79 | MAPK14 (0.60) | MAPK14CCR3CHRM2OXTRACHE |
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-2029534-B1 | 1H-INDOL-5-YL-PIPERAZIN-1-YL-METHANONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2010-12-22 | — | — | EP | disclosed |