Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 4/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.36 |
| ▸ | PHGDH | O43175 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.33 |
| ▸ | FEN1 | P39748 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.32 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL25554071 | 1.00 | CYP11B1 (0.40) | CYP11B1CYP19A1CYP11B2SCN9APIN1 | |
| SCHEMBL25554271 | 0.93 | SCN9A (0.40) | CYP11B1CYP19A1CYP11B2SCN9APIN1 | |
| SCHEMBL30353051 | 0.93 | SCN9A (0.40) | CYP11B1CYP19A1CYP11B2SCN9APIN1 | |
| SCHEMBL25554077 | 0.92 | CYP11B2 (0.47) | CYP11B1CYP19A1CYP11B2SCN9AKDM4E | |
| SCHEMBL25554088 | 0.92 | NSD2 (0.37) | CYP11B1CYP19A1CYP11B2SCN9ANSD2 | |
| SCHEMBL30353115 | 0.92 | NSD2 (0.37) | CYP11B1CYP19A1CYP11B2SCN9ANSD2 | |
| SCHEMBL30353104 | 0.92 | GRM5 (0.38) | CYP11B1CYP19A1CYP11B2SCN9ANSD2 | |
| SCHEMBL25554119 | 0.92 | GRM5 (0.38) | CYP11B1CYP19A1CYP11B2SCN9ANSD2 | |
| SCHEMBL25554706 | 0.90 | CYP11B1 (0.36) | CYP11B1CYP19A1CYP11B2SCN9ANSD2 | |
| SCHEMBL25554247 | 0.90 | CYP11B1 (0.41) | CYP11B1CYP19A1CYP11B2SCN9APIN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115996910-A | Aryl or heteroaryl derivatives | 帝人制药株式会社 | 2023-04-21 | — | — | CN | claimed |
| CN-115996910-A | Aryl or heteroaryl derivatives | 帝人制药株式会社 | 2023-04-21 | — | — | CN | disclosed |