Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | NOS3 | P29474 | 2/20 | 0.47 |
| ▸ | NOS2 | P35228 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | PTAFR | P25105 | 2/20 | 0.39 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTR2B | P41595 | 2/20 | 0.38 |
| ▸ | METAP1 | P53582 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28110445 | 0.86 | ALDH1A1 (0.56) | ALDH1A1KDM4ENOS3NOS2PTAFR | |
| SCHEMBL29361631 | 0.77 | KDM4E (0.60) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL7509399 | 0.77 | KDM4E (0.60) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL30952110 | 0.75 | ALDH1A1 (1.00) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL14919523 | 0.75 | ALDH1A1 (1.00) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL22995932 | 0.75 | KDM4E (0.63) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL30952113 | 0.75 | KDM4E (0.63) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL28122092 | 0.75 | KDM4E (0.58) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL7819962 | 0.75 | KDM4E (0.58) | ALDH1A1KDM4ENOS3NOS2MAOA | |
| SCHEMBL9815282 | 0.75 | ALDH1A1 (0.58) | ALDH1A1KDM4ENOS3NOS2MAOA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7820692-B2 | Tetrahydro isoquinoline derivatives, preparation methods and medicinal uses thereof | CHINA PHARMACEUTICAL UNIVERSITY (CN) | 2010-10-26 | — | — | US | disclosed |
| US-20090275607-A1 | Tetrahydro isoquinoline derivatives, preparation methods and medicinal uses thereof | CHINA PHARMACEUTICAL UNIVERSITY (CN) | 2009-11-05 | — | — | US | disclosed |
| CN-100503571-C | Tetrahydro isoquinoline derivative and its preparation process and medicine use | UNIV CHINA PHARMA (CN) | 2009-06-24 | — | — | CN | disclosed |
| EP-2045243-A1 | TETRAHYDRO ISOQUINOLINE DERIVATIVES, PREPARATION METHODS AND MEDICINAL USES THEREOF | China Pharmaceutical University (CN) | 2009-04-08 | — | — | EP | disclosed |
| CN-1887872-A | Tetrahydro isoquinoline derivative and its prepn process and medicine use | UNIV CHINA PHARMACY (CN) | 2007-01-03 | — | — | CN | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20090275607-A1 | Tetrahydro isoquinoline derivatives, preparation methods and medicinal uses thereof | OPRK1, OPRD1, OPRL1 | ALDH1A1 1231/4885KDM4E 1973/4885NOS3 706/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.