Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | DHFR | P00374 | 3/20 | 0.38 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.33 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 1/20 | 0.32 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5029294 | 0.89 | DHFR (0.41) | DHFRALDH1A1HCAR2 | |
| SCHEMBL6964698 | 0.89 | LMNA (0.36) | PDE9APDE1APDE1BPDE1CSLC6A4 | |
| SCHEMBL6974600 | 0.88 | TSHR (0.33) | TSHRCAPN1VCPALDH1A1PDE9A | |
| SCHEMBL5852619 | 0.88 | TACR1 (0.34) | TSHRCAPN1VCPPDE9APDE1A | |
| SCHEMBL14439851 | 0.87 | TSHR (0.41) | TSHRCAPN1VCPALDH1A1PDE9A | |
| SCHEMBL14002290 | 0.84 | DHFR (0.36) | DHFRALDH1A1ALOX5 | |
| SCHEMBL6973717 | 0.79 | LMNA (0.35) | DHFRALDH1A1TOP2AHCAR2 | |
| SCHEMBL6971891 | 0.79 | ALDH1A1 (0.37) | CAPN1ALDH1A1HCAR2 | |
| SCHEMBL4893143 | 0.79 | TSHR (0.43) | TSHRCAPN1VCPALDH1A1PDE9A | |
| SCHEMBL6962307 | 0.77 | CYP1A2 (0.35) | DHFRALDH1A1CA1CA2HCAR2 |
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-20070190523-A1 | Method and compositions for identifying anti-hiv therapeutic compounds | GILEAD SCIENCES, INC. | 2007-08-16 | — | — | US | disclosed |