Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 2/20 | 0.36 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | RXRG | P48443 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30847650 | 0.76 | ALOX5 (0.39) | ALDH1A1MEN1KMT2AARPTPN2 | |
| SCHEMBL29317051 | 0.75 | PPARG (0.41) | ALDH1A1MEN1KMT2APTPN2PTPN1 | |
| SCHEMBL29317061 | 0.75 | PPARG (0.41) | ALDH1A1MEN1KMT2AARMAOB | |
| SCHEMBL30847795 | 0.75 | CYP1A2 (0.41) | HTTALDH1A1MEN1KMT2APTPN2 | |
| SCHEMBL29317005 | 0.74 | HTT (0.51) | HTTMEN1KMT2AHCAR1 | |
| SCHEMBL15898915 | 0.71 | RXRA (0.42) | ALDH1A1MEN1KMT2AARPTPN2 | |
| SCHEMBL30847726 | 0.70 | DRD2 (0.38) | ALDH1A1MEN1KMT2AARPTPN2 | |
| SCHEMBL8721128 | 0.70 | HCAR1 (0.55) | HTTALDH1A1MEN1KMT2AHCAR1 | |
| SCHEMBL6173722 | 0.70 | RAB9A (0.60) | L3MBTL1GAAMAOBMAOANR1H4 | |
| SCHEMBL29316276 | 0.70 | ROCK2 (0.39) | ALDH1A1MEN1KMT2APTPN2PTPN1 |
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-2024147972-A2 | DNA POLYMERASE THETA INHIBITORS CONTAINING NON-SATURATED 5-MEMBERED HETEROCYCLIC RINGS AND USE THEREOF | THOMAS JEFFERSON UNIVERSITY (US) | 2024-07-11 | — | — | WO | disclosed |