Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.35 |
| ▸ | KDM2B | Q8NHM5 | 3/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KDM4A | O75164 | 1/20 | 0.34 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14641897 | 0.83 | KDM4C (0.50) | PIK3CAHRH3KDM4CKDM5ANPC1 | |
| SCHEMBL29139858 | 0.82 | PROKR1 (0.48) | PIK3CAHRH3MAPK13KDM4CUSP30 | |
| Nitrous Acid SCHEMBL29139859 | 0.80 | PIK3CA (0.57) | PIK3CAKDM4CKDM2BKDM5AKDM5B | |
| SCHEMBL29139863 | 0.79 | PIK3CA (0.63) | PIK3CAKDM4CKDM2BKDM5AKDM5B | |
| SCHEMBL30775160 | 0.79 | PIK3CA (0.63) | PIK3CAKDM4CKDM2BKDM5AKDM5B | |
| SCHEMBL28781584 | 0.72 | NPC1 (0.42) | KDM4CKDM5ANPC1RAB9AKDM5B | |
| SCHEMBL28404952 | 0.71 | MAPT (0.44) | KDM4CNPC1RAB9AALDH1A1POLB | |
| SCHEMBL29072870 | 0.71 | KMT2A (0.43) | KDM4CNPC1RAB9AALDH1A1POLB | |
| SCHEMBL28381981 | 0.71 | NPC1 (0.39) | KDM4CKDM5ANPC1RAB9AKDM5B | |
| SCHEMBL28394531 | 0.71 | GABRP (0.58) | KDM4CNPC1RAB9AALDH1A1POLB |
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 |