Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 11/20 | 0.44 |
| ▸ | HSD17B13 | Q7Z5P4 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | KDM5A | P29375 | 2/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | KDM4C | Q9H3R0 | 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 | |
|---|---|---|---|---|
| SCHEMBL19202591 | 0.88 | NR1H4 (0.45) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| Nitrous Acid SCHEMBL29139870 | 0.85 | NR1H4 (0.51) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| SCHEMBL30775159 | 0.85 | NR1H4 (0.53) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| SCHEMBL29139872 | 0.85 | NR1H4 (0.53) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| SCHEMBL17843286 | 0.78 | HRH3 (0.43) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| SCHEMBL30064306 | 0.74 | MALT1 (0.40) | NR1H4HSD17B13 | |
| SCHEMBL19689487 | 0.74 | MALT1 (0.40) | NR1H4HSD17B13 | |
| SCHEMBL29139857 | 0.71 | PIK3CA (0.44) | PIK3CAKDM5AKDM5BNPC1MAPT | |
| SCHEMBL19202590 | 0.71 | NR1H4 (0.46) | NR1H4HSD17B13PIK3CAKDM5AKDM5B | |
| SCHEMBL29139858 | 0.70 | PROKR1 (0.48) | PIK3CAKDM5AKDM5BNPC1RAB9A |
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 |