Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRN | P28799 | 2/20 | 0.41 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.41 |
| ▸ | NQO1 | P15559 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | PYGL | P06737 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | SSTR4 | P31391 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29213465 | 1.00 | GRN (0.41) | GRNSORT1NQO1KMT2AADORA2A | |
| SCHEMBL29213441 | 0.86 | ROS1 (0.43) | KMT2AGLSKDM4EALDH1A1TDP1 | |
| SCHEMBL29213443 | 0.86 | ROS1 (0.43) | KMT2AGLSKDM4EALDH1A1TDP1 | |
| SCHEMBL31052813 | 0.81 | GRN (0.43) | GRNSORT1KMT2APYGLCYP2C9 | |
| SCHEMBL29213243 | 0.80 | KMT2A (0.41) | GRNSORT1NQO1KMT2AADORA2A | |
| SCHEMBL29213242 | 0.80 | KMT2A (0.41) | GRNSORT1NQO1KMT2AADORA2A | |
| SCHEMBL29213429 | 0.79 | GRN (0.42) | GRNSORT1NQO1KMT2APYGL | |
| SCHEMBL29213426 | 0.79 | GRN (0.42) | GRNSORT1NQO1KMT2APYGL | |
| Hydrochloric Acid SCHEMBL29213411 | 0.78 | GRN (0.41) | GRNSORT1NQO1KMT2APYGL | |
| Hydrochloric Acid SCHEMBL29213415 | 0.78 | GRN (0.41) | GRNSORT1NQO1KMT2APYGL |
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-118019533-A | 2-Amino-5, 5-dimethylhexanoic acid derivatives as sortilin modulators for the treatment of central nervous system diseases | 因苏森斯有限公司 | 2024-05-10 | — | — | CN | claimed |
| CN-118019533-A | 2-Amino-5, 5-dimethylhexanoic acid derivatives as sortilin modulators for the treatment of central nervous system diseases | 因苏森斯有限公司 | 2024-05-10 | — | — | CN | disclosed |