Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TACR1 | P25103 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9565489 | 1.00 | TSHR (0.45) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL28306256 | 0.80 | TSHR (0.54) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL2221074 | 0.76 | TSHR (0.48) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL763893 | 0.76 | TSHR (0.48) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL1857389 | 0.76 | TSHR (0.48) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL1857390 | 0.76 | TSHR (0.48) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL599239 | 0.75 | TSHR (0.47) | TSHRTACR1 | |
| SCHEMBL26124613 | 0.75 | TSHR (0.47) | TSHRTACR1CA1CA2CA7 | |
| SCHEMBL9565492 | 0.74 | TSHR (0.39) | TSHRTACR1EPHX2 | |
| SCHEMBL9565495 | 0.74 | TSHR (0.39) | TSHRTACR1EPHX2 |
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-0554025-A2 | Fluorinated cyclobutyl purines and pyrimidines | E.R. SQUIBB & SONS, INC. (US) | 1993-08-04 | — | — | EP | disclosed |