Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | TACR2 | P21452 | 2/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | TST | Q16762 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8121822 | 0.82 | PTGS1 (0.42) | HTR2AESR1LMNAADRB3CHRM1 | |
| SCHEMBL28771738 | 0.81 | BDKRB2 (0.40) | HTR2AESR1ADRA2AADORA3TACR2 | |
| SCHEMBL9596403 | 0.81 | PTGS1 (0.41) | HTR2AESR1LMNAADRB3CHRM1 | |
| SCHEMBL9335334 | 0.81 | PTGS1 (0.41) | HTR2AESR1LMNAADRB3CHRM1 | |
| SCHEMBL11894779 | 0.80 | LPL (0.42) | HTR2AESR1ADORA3SLC6A2SLC6A3 | |
| SCHEMBL8692586 | 0.79 | SLC2A1 (0.39) | HTR2AALDH1A1KDM4ELMNATP53 | |
| SCHEMBL4459353 | 0.79 | SIGMAR1 (0.44) | HTR2AALDH1A1KDM4ELMNALCK | |
| Hydrogen Sulfide SCHEMBL11703442 | 0.78 | ESR1 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL28063717 | 0.78 | ESR1 (0.48) | ESR1ADRA2AADORA3TACR2SLC6A2 | |
| SCHEMBL8702374 | 0.77 | BDKRB2 (0.32) | HTR2ACYP3A4BDKRB2S1PR2S1PR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995023143-A1 | INDOLE DERIVATIVES AS TESTOSTERONE-5-ALPHA-REDUCTASE INHIBITORS | PFIZER LIMITED (GB) | 1995-08-31 | — | — | WO | disclosed |