Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.44 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.44 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8950839 | 1.00 | TSHR (0.44) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL14541169 | 1.00 | TSHR (0.44) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL5654192 | 0.84 | TRPA1 (0.55) | TSHRALDH1A1ADRA2BADRA2CSLC6A2 | |
| SCHEMBL8382957 | 0.83 | TRPA1 (0.45) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL8382959 | 0.83 | TRPA1 (0.45) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL26987985 | 0.81 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL26989268 | 0.81 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL26988540 | 0.81 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL428101 | 0.81 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C | |
| SCHEMBL26988083 | 0.81 | TSHR (0.46) | TSHRALDH1A1SMN1; SMN2ADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| US-5550291-A | Process for key intermediates for HIV protease inhibitors | BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH, INC. (CA) | 1996-08-27 | — | — | US | disclosed |