Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3E | A5X5Y0 | 3/20 | 0.45 |
| ▸ | HTR3B | O95264 | 3/20 | 0.45 |
| ▸ | HTR3A | P46098 | 3/20 | 0.45 |
| ▸ | HTR3D | Q70Z44 | 3/20 | 0.45 |
| ▸ | HTR3C | Q8WXA8 | 3/20 | 0.45 |
| ▸ | CDK8 | P49336 | 2/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.42 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.42 |
| ▸ | F10 | P00742 | 1/20 | 0.42 |
| ▸ | FLT1 | P17948 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21268731 | 0.81 | PLD1 (0.44) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL30178157 | 0.81 | BRD9 (0.46) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL30778595 | 0.78 | CDK8 (0.41) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL24126733 | 0.78 | F10 (0.41) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| Hydrochloric Acid SCHEMBL7099422 | 0.76 | F10 (0.40) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL7016069 | 0.75 | ALDH1A1 (0.40) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL30232598 | 0.74 | F10 (0.37) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL17889457 | 0.74 | PRKCQ (0.40) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL21268742 | 0.72 | F10 (0.39) | CDK8ROCK1CHEK1MAP4K4CSF1R | |
| SCHEMBL5543916 | 0.72 | HTR3A (0.41) | HTR3EHTR3BHTR3AHTR3DHTR3C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024092069-A1 | CXCR4 INHIBITORS FOR TREATMENT OF NEUROLOGICAL DISEASES | X4 PHARMACEUTICALS, INC. (US) | 2024-05-02 | — | — | WO | disclosed |
| EP-3808748-A1 | SUBSTITUTED PIPERIDINES AS CXCR4-INHIBITORS | X4 Pharmaceuticals, Inc. (US) | 2021-04-21 | — | — | EP | disclosed |
| EP-3471727-B1 | CXCR4 INHIBITORS AND USES THEREOF | X4 PHARMACEUTICALS INC (US) | 2020-12-09 | — | — | EP | disclosed |