Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 11/20 | 0.51 |
| ▸ | P2RY12 | Q9H244 | 4/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19689507 | 1.00 | NR1H4 (0.51) | NR1H4P2RY12ABL1HDAC3HDAC1 | |
| SCHEMBL19689515 | 0.84 | NR1H4 (0.51) | NR1H4P2RY12ABL1 | |
| SCHEMBL30775168 | 0.84 | NR1H4 (0.51) | NR1H4P2RY12ABL1 | |
| SCHEMBL19699381 | 0.82 | NR1H4 (0.46) | NR1H4HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL19202591 | 0.78 | NR1H4 (0.45) | NR1H4 | |
| SCHEMBL17843228 | 0.77 | CRBN (0.52) | NR1H4P2RY12 | |
| SCHEMBL19690321 | 0.77 | NR1H4 (0.40) | NR1H4 | |
| SCHEMBL30775163 | 0.76 | NR1H4 (0.77) | NR1H4 | |
| SCHEMBL19689549 | 0.76 | NR1H4 (0.77) | NR1H4 | |
| SCHEMBL19689491 | 0.75 | NR1H4 (0.86) | NR1H4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117924266-A | Compounds that modulate FXR (NR 1H 4) | 吉利德科学公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-117924267-A | Compounds that modulate FXR (NR 1H 4) | 吉利德科学公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-109476636-B | Compounds that modulate FXR (NR 1H 4) | 吉利德科学公司 | 2024-01-09 | — | — | CN | disclosed |