Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.60 |
| ▸ | CCR3 | P51677 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.42 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | OXTR | P30559 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL3388657 | 0.98 | MAPK14 (0.60) | MAPK14CCR3KDM4EALDH1A1ACHE | |
| SCHEMBL3383892 | 0.95 | MAPK14 (0.64) | MAPK14CCR3KDM4EALDH1A1ACHE | |
| SCHEMBL3388648 | 0.92 | KDM4E (0.56) | KDM4EALDH1A1ACHEKMT2AHRH3 | |
| SCHEMBL3387943 | 0.90 | KDM4E (0.56) | KDM4EALDH1A1ACHEKMT2AHRH3 | |
| SCHEMBL3390881 | 0.89 | MAPK14 (0.59) | MAPK14CCR3KDM4EALDH1A1ACHE | |
| SCHEMBL3391056 | 0.89 | MAPK14 (0.59) | MAPK14CCR3KDM4EALDH1A1ACHE | |
| SCHEMBL3390449 | 0.87 | MAPK14 (0.57) | MAPK14CCR3KDM4EACHEHTR4 | |
| SCHEMBL3387912 | 0.87 | KDM4E (0.60) | MAPK14KDM4EALDH1A1ACHEKMT2A | |
| SCHEMBL3387677 | 0.85 | MAPK14 (0.56) | MAPK14CCR3KDM4EALDH1A1ACHE | |
| SCHEMBL3388485 | 0.84 | MAPK14 (0.56) | MAPK14CCR3KDM4EALDH1A1ACHE |
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 |