Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGIR | P43119 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.47 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | CXCR4 | P61073 | 3/20 | 0.46 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.44 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.44 |
| ▸ | KCNJ1 | P48048 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL17186327 | 0.79 | CXCR4 (0.53) | PTGIRADRA2AADRA2BADRA2CCXCR4 | |
| SCHEMBL11132646 | 0.78 | CXCR4 (0.56) | PTGIRADRA2AADRA2BADRA2CCXCR4 | |
| Hydrochloric Acid SCHEMBL27650682 | 0.77 | MAOA (0.59) | PTGIRGFERHTR1DKCNH2KCNJ1 | |
| Hydrochloric Acid SCHEMBL4714075 | 0.77 | MAOA (0.59) | PTGIRGFERHTR1DKCNH2KCNJ1 | |
| Hydrochloric Acid SCHEMBL17186187 | 0.77 | CXCR4 (0.51) | PTGIRADRA2AADRA2BADRA2CCXCR4 | |
| Hydrochloric Acid SCHEMBL4714070 | 0.76 | MAOA (0.58) | PTGIRGFERHTR1DKCNH2KCNJ1 | |
| SCHEMBL6977059 | 0.76 | PTGIR (0.84) | PTGIRADRA2AADRA2BADRA2CHTR1D | |
| SCHEMBL3721781 | 0.75 | GFER (0.54) | PTGIRGFERHTR1DKCNH2KCNJ1 | |
| SCHEMBL6375440 | 0.73 | HRH3 (0.43) | KCNH2KCNJ1TSHRCA1CA2 | |
| SCHEMBL19874574 | 0.71 | TSHR (0.58) | KCNH2KCNJ1TSHRCA1CA2 |
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-2023287736-A1 | NOVEL BIS-AMIDE CONTAINING COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2023-01-19 | — | — | WO | disclosed |