Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | ECE1 | P42892 | 1/20 | 0.31 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | CTSL | P07711 | 1/20 | 0.31 |
| ▸ | CTSB | P07858 | 1/20 | 0.31 |
| ▸ | CTSH | P09668 | 1/20 | 0.31 |
| ▸ | CTSK | P43235 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9559401 | 1.00 | TSHR (0.34) | TSHRNR1H2NR1H3ECE1P2RX4 | |
| SCHEMBL23420299 | 0.78 | JAK3 (0.32) | TSHR | |
| SCHEMBL21078477 | 0.73 | TSHR (0.36) | TSHRCTSLCTSBCTSHCTSK | |
| SCHEMBL27979463 | 0.73 | PIK3CD (0.50) | TSHRCYP2D6CTSKALDH1A1 | |
| SCHEMBL13933961 | 0.72 | POLB (0.48) | NR1H2ALDH1A1 | |
| SCHEMBL16857355 | 0.71 | CHRM2 (0.41) | NR1H2 | |
| SCHEMBL16857357 | 0.71 | CHRM2 (0.41) | NR1H2 | |
| SCHEMBL16857354 | 0.71 | CHRM2 (0.41) | NR1H2 | |
| SCHEMBL13034053 | 0.68 | POLB (0.51) | ALDH1A1 | |
| SCHEMBL15254603 | 0.68 | HSD11B1 (0.48) | NR1H2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-5255243-A | — | — | None | — | — | JP | disclosed |
| JP-H05255243-A | AZIRIDINE-2-CARBOXYLIC ACID DERIVATIVE AND ITS PRODUCTION | NIPPON STEEL CORP | 1993-10-05 | — | — | JP | disclosed |