Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROS1 | P08922 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 6/20 | 0.41 |
| ▸ | MAPK9 | P45984 | 6/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 6/20 | 0.41 |
| ▸ | GLS | O94925 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29213441 | 1.00 | ROS1 (0.43) | ROS1RPS6KB1MAPK8MAPK9MAPK10 | |
| SCHEMBL29213243 | 0.91 | KMT2A (0.41) | MAPK8MAPK9MAPK10KMT2ATRPV1 | |
| SCHEMBL29213242 | 0.91 | KMT2A (0.41) | MAPK8MAPK9MAPK10KMT2ATRPV1 | |
| SCHEMBL29213462 | 0.86 | GRN (0.41) | KMT2AGLSSLC22A12SSTR4KDM4E | |
| SCHEMBL29213465 | 0.86 | GRN (0.41) | KMT2AGLSSLC22A12SSTR4KDM4E | |
| SCHEMBL29213337 | 0.81 | PDCD1 (0.40) | KMT2AKDM4EALDH1A1TDP1 | |
| SCHEMBL30903296 | 0.81 | PDCD1 (0.40) | KMT2AKDM4EALDH1A1TDP1 | |
| SCHEMBL29213332 | 0.81 | PDCD1 (0.40) | KMT2AKDM4EALDH1A1TDP1 | |
| SCHEMBL29213372 | 0.80 | KDM4E (0.39) | KDM4EALDH1A1 | |
| SCHEMBL29213369 | 0.80 | KDM4E (0.39) | KDM4EALDH1A1 |
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 |