Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | KAT8 | Q9H7Z6 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | TACR2 | P21452 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7071459 | 1.00 | TYR (0.44) | TYRKAT8ESR1ADRA2AADORA3 | |
| SCHEMBL8443514 | 0.94 | HPGD (0.41) | TYRESR1CYP3A4KDM4EALDH1A1 | |
| SCHEMBL10597298 | 0.90 | TYR (0.46) | TYRKAT8ESR1ADRA2AADORA3 | |
| SCHEMBL9142782 | 0.90 | TYR (0.46) | TYRKAT8ESR1ADRA2AADORA3 | |
| SCHEMBL11555596 | 0.90 | TYR (0.46) | TYRKAT8ESR1ADRA2AADORA3 | |
| SCHEMBL11806944 | 0.89 | TYR (0.45) | TYRKAT8ESR1ADRA2AADORA3 | |
| SCHEMBL8764140 | 0.89 | S1PR2 (0.39) | TYRESR1ADRA2AADORA3TACR2 | |
| SCHEMBL28132483 | 0.83 | TYR (0.41) | TYRKAT8TP53CYP3A4ALOX5 | |
| SCHEMBL4208635 | 0.82 | ESR1 (0.39) | ESR1TP53CYP3A4KDM4EALDH1A1 | |
| SCHEMBL11596718 | 0.80 | TYR (0.54) | TYRKAT8TP53CYP3A4ALOX5 |
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-0014815-A2 | Peptide derivatives, process for their preparation and intermediates, and pharmaceutical compositions containing one of these compounds | CIBA-GEIGY AG (CH) | 1980-09-03 | — | — | EP | disclosed |