Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 4/20 | 0.40 |
| ▸ | CETP | P11597 | 4/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | YAP1 | P46937 | 1/20 | 0.34 |
| ▸ | THRA | P10827 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL30847657 | 0.78 | SCN5A (0.43) | TACR1CETPPTPN2PTPN1PTPN6 | |
| SCHEMBL29317051 | 0.77 | PPARG (0.41) | TACR1PTPN2PTPN1PTPN6MEN1 | |
| SCHEMBL30847795 | 0.72 | CYP1A2 (0.41) | TACR1PTPN2PTPN1PTPN6RXRA | |
| SCHEMBL30847650 | 0.67 | ALOX5 (0.39) | TACR1PTPN2PTPN1PTPN6RXRA | |
| SCHEMBL29317047 | 0.67 | HTT (0.44) | PTPN2PTPN1PTPN6RXRARXRB | |
| SCHEMBL30847726 | 0.66 | DRD2 (0.38) | TACR1PTPN2PTPN1PTPN6RXRA | |
| SCHEMBL34465627 | 0.65 | GPR119 (0.54) | TACR1TLR9TLR7YAP1 | |
| SCHEMBL30847685 | 0.64 | MEN1 (0.35) | TACR1MEN1ALDH1A1KMT2A | |
| SCHEMBL15898915 | 0.64 | RXRA (0.42) | PTPN2PTPN1PTPN6RXRARXRB | |
| SCHEMBL17305374 | 0.62 | TLR9 (0.49) | TACR1RXRARXRBRXRGTLR9 |
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 |