Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPD1 | P10809 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | CPT2 | P23786 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | ACACA | Q13085 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29060121 | 0.81 | CPB2 (0.34) | CA2KMT2A | |
| SCHEMBL9101043 | 0.80 | CA2 (0.48) | HSPD1BLMHSPE1TDP1FFAR1 | |
| SCHEMBL11307885 | 0.80 | CA2 (0.48) | HSPD1BLMHSPE1TDP1FFAR1 | |
| SCHEMBL11299270 | 0.80 | CA2 (0.48) | HSPD1BLMHSPE1TDP1FFAR1 | |
| SCHEMBL18918256 | 0.80 | HSPD1 (0.40) | HSPD1BLMHSPE1FFAR1MEN1 | |
| SCHEMBL12044154 | 0.79 | — | — | |
| SCHEMBL4521467 | 0.79 | HSPD1 (0.54) | HSPD1BLMHSPE1FFAR1CA2 | |
| SCHEMBL19861304 | 0.78 | TDP1 (0.41) | TDP1FFAR1CPT2CA2MAPK1 | |
| SCHEMBL6249423 | 0.77 | HSPD1 (0.57) | HSPD1BLMHSPE1FFAR1MEN1 | |
| SCHEMBL6255008 | 0.77 | HSPD1 (0.57) | HSPD1BLMHSPE1FFAR1MEN1 |
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-116670140-A | Macrocyclic compounds containing 1,3, 4-oxadiazole rings as modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-08-29 | — | — | CN | disclosed |