Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | HRH1 | P35367 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1061357 | 0.93 | CA2 (0.55) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL27489586 | 0.86 | NAAA (0.55) | HTR2CMAPK1CA2NAAASLC1A2 | |
| SCHEMBL27578440 | 0.85 | NAAA (0.53) | HTR2CMAPK1CA2NAAASLC1A2 | |
| SCHEMBL29202602 | 0.84 | CA1 (0.53) | MAPK1CA2NAAAALDH1A1ATM | |
| SCHEMBL8669263 | 0.84 | NAAA (0.60) | HTR2CMAPK1NAAAHCAR2NPSR1 | |
| SCHEMBL454062 | 0.83 | TDP1 (0.58) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL8797367 | 0.83 | NAAA (0.42) | MAPK1CA2NAAAALDH1A1SLC1A2 | |
| SCHEMBL10066601 | 0.83 | GRIK1 (0.50) | MAPK1CA2NAAASLC1A2SLC1A1 | |
| SCHEMBL18675750 | 0.81 | DGKA (0.57) | HTR2CNAAAALDH1A1MAPTDGKA | |
| SCHEMBL10477474 | 0.81 | ALDH1A1 (0.50) | HTR2CTDP1MAPK1NAAAALDH1A1 |
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-0807114-A1 | BRIDGED INDOLES AS MATRIX METALLOPROTEASE INHIBITORS | SYNTEX (U.S.A.) INC. (US) | 1997-11-19 | — | — | EP | disclosed |