Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 7/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.33 |
| ▸ | GCK | P35557 | 1/20 | 0.33 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29149136 | 0.75 | TPMT (0.36) | HSD17B10THRATHRBALDH1A1 | |
| SCHEMBL28857874 | 0.73 | HTT (0.50) | CYP2C9HIF1AKDM4EHSD17B10HPGD | |
| SCHEMBL30011755 | 0.72 | NPC1 (0.59) | FFAR1NPC1RAB9ACAPN1CYP2C9 | |
| SCHEMBL1535890 | 0.72 | NPC1 (0.59) | FFAR1NPC1RAB9ACAPN1CYP2C9 | |
| SCHEMBL31484818 | 0.71 | CHEK1 (0.41) | NPC1RAB9AGCKCAPN1PTGES | |
| SCHEMBL31484834 | 0.69 | LMNA (0.47) | NPC1RAB9AKDM4EHSD17B10HPGD | |
| SCHEMBL29789031 | 0.68 | NPC1 (0.54) | FFAR1NPC1RAB9ACAPN1KDM4E | |
| SCHEMBL2256468 | 0.68 | NPC1 (0.72) | FFAR1NPC1RAB9AFFAR4CAPN1 | |
| SCHEMBL29479413 | 0.68 | NPC1 (0.72) | FFAR1NPC1RAB9AFFAR4CAPN1 | |
| SCHEMBL30607509 | 0.68 | NPC1 (0.67) | FFAR1NPC1RAB9AFFAR4CAPN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-117447402-A | Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof | 德明药泰生物技术（深圳）有限公司 | 2024-01-26 | — | — | CN | disclosed |