Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | HTR1D | P28221 | 2/20 | 0.41 |
| ▸ | HTR2C | P28335 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR5A | P47898 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 5/20 | 0.39 |
| ▸ | NNMT | P40261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL3517633 | 0.86 | KDM4E (0.47) | HSD17B10ALDH1A1KDM4EKMT2ALCK | |
| SCHEMBL7510413 | 0.84 | KDM4E (0.50) | HSD17B10ALDH1A1KDM4ETSHRKMT2A | |
| SCHEMBL16863983 | 0.84 | HSD17B10 (0.42) | HSD17B10ALDH1A1KDM4EHTR1AHTR1D | |
| SCHEMBL2858379 | 0.82 | HSD17B10 (0.41) | HSD17B10ALDH1A1KDM4EHTR1AHTR1D | |
| SCHEMBL27870060 | 0.79 | ATM (0.44) | HSD17B10ALDH1A1KDM4ETSHRKMT2A | |
| SCHEMBL8149097 | 0.78 | PARP1 (0.46) | HSD17B10ALDH1A1KDM4EHTR1AHTR1D | |
| SCHEMBL27722327 | 0.78 | SLC6A4 (0.47) | HSD17B10HTR1AHTR1DHTR2CTSHR | |
| SCHEMBL1857252 | 0.78 | PARP1 (0.46) | HSD17B10HTR1AHTR1DHTR2CTSHR | |
| SCHEMBL6112695 | 0.78 | HRH4 (0.46) | HSD17B10ALDH1A1KDM4ELCKPARP1 | |
| SCHEMBL15862062 | 0.78 | KDM4E (0.62) | HSD17B10ALDH1A1KDM4ESMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-20020032262-A1 | 2-aminoarylmethylamine solid support templated for preparation of highly functionalized heterocycle compounds | ZHANG JINFANG (US) | 2002-03-14 | — | — | US | disclosed |