Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | CDK4 | P11802 | 3/20 | 0.43 |
| ▸ | CCND1 | P24385 | 3/20 | 0.43 |
| ▸ | LSS | P48449 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23657411 | 0.89 | CDK4 (0.47) | SMPD1CDK4CCND1MAPK1MEN1 | |
| SCHEMBL23657410 | 0.83 | DRD3 (0.50) | CDK4CCND1NPC1ALDH1A1RAB9A | |
| SCHEMBL29824219 | 0.80 | ALDH1A1 (0.56) | HTR2AHTR2CSMPD1MEN1KMT2A | |
| SCHEMBL23649039 | 0.80 | ALDH1A1 (0.56) | HTR2AHTR2CSMPD1MEN1KMT2A | |
| SCHEMBL23657362 | 0.76 | HTR5A (0.53) | HTR2ALSSMEN1KMT2AALDH1A1 | |
| SCHEMBL23657403 | 0.75 | HRH3 (0.54) | LSSALDH1A1SMN1; SMN2DRD2DRD3 | |
| SCHEMBL3990419 | 0.75 | HTR2C (0.81) | HTR2AHTR2CSMPD1CDK4CCND1 | |
| SCHEMBL23657212 | 0.74 | HRH3 (0.55) | LSSALDH1A1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL11486417 | 0.74 | HTR2A (0.78) | HTR2AHTR2CSMPD1CDK4CCND1 | |
| SCHEMBL23657376 | 0.71 | SMN1; SMN2 (0.48) | MEN1KMT2ANPC1ALDH1A1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021145729-A1 | NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF | DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) | 2021-07-22 | — | — | WO | disclosed |