Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ERBB2 | P04626 | 12/20 | 0.38 |
| ▸ | EGFR | P00533 | 11/20 | 0.38 |
| ▸ | BTK | Q06187 | 3/20 | 0.38 |
| ▸ | ERBB4 | Q15303 | 2/20 | 0.38 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.38 |
| ▸ | BLK | P51451 | 1/20 | 0.38 |
| ▸ | BMX | P51813 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29989219 | 1.00 | SLC6A4 (0.40) | SLC6A4ERBB2EGFRBTKERBB4 | |
| SCHEMBL28956018 | 0.85 | BTK (0.47) | SLC6A4ERBB2EGFRBTKERBB4 | |
| SCHEMBL29989278 | 0.85 | BTK (0.47) | SLC6A4ERBB2EGFRBTKERBB4 | |
| SCHEMBL28859066 | 0.81 | BTK (0.58) | ERBB2EGFRBTKERBB4BLK | |
| SCHEMBL28647880 | 0.80 | EGFR (0.45) | ERBB2EGFRBTKERBB4BLK | |
| SCHEMBL8819946 | 0.78 | BTK (0.43) | SLC6A4EGFRBTKKCNH2 | |
| SCHEMBL29989239 | 0.76 | ACVRL1 (0.54) | SLC6A4ERBB2EGFRBTKERBB4 | |
| SCHEMBL19230428 | 0.76 | BTK (0.56) | BTK | |
| SCHEMBL29989357 | 0.75 | TNK2 (0.53) | ERBB2EGFRBTKERBB4BLK | |
| SCHEMBL409545 | 0.74 | HTR6 (0.43) | EGFRBTKRPS6KB1HTR2AHTR2C |
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-113493439-B | Substituted acrylamide derivative, composition and application thereof | 深圳市塔吉瑞生物医药有限公司 | 2022-10-14 | — | — | CN | disclosed |
| CN-113493439-A | Substituted acrylamide derivative, composition and application thereof | 深圳市塔吉瑞生物医药有限公司 | 2021-10-12 | — | — | CN | disclosed |