Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRB | P24530 | 3/20 | 0.34 |
| ▸ | EDNRA | P25101 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | XBP1 | P17861 | 1/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Mukaadial SCHEMBL21025699 | 1.00 | EDNRB (0.34) | EDNRBEDNRAMAPTCYP3A4RECQL | |
| Cinnamodial SCHEMBL15557354 | 0.80 | EDNRB (0.41) | EDNRBEDNRAMAPTCYP3A4LMNA | |
| Cinnamodial SCHEMBL20462860 | 0.80 | EDNRB (0.41) | EDNRBEDNRAMAPTCYP3A4LMNA | |
| Warburganal SCHEMBL13855683 | 0.73 | CHRNB2 (0.45) | MAPTIDO1TRPA1ALDH1A1CHRNB2 | |
| Warburganal SCHEMBL4244667 | 0.73 | CHRNB2 (0.45) | MAPTIDO1TRPA1ALDH1A1CHRNB2 | |
| Warburganal SCHEMBL288951 | 0.73 | CHRNB2 (0.45) | MAPTIDO1TRPA1ALDH1A1CHRNB2 | |
| SCHEMBL11130748 | 0.67 | PDE4D (0.45) | MAPTCYP3A4TRPA1ALDH1A1LMNA | |
| Pereniporin B SCHEMBL21025895 | 0.65 | NFKB1 (0.34) | EDNRBEDNRAMAPTCYP3A4RECQL | |
| SCHEMBL11451547 | 0.61 | TRPA1 (0.34) | MAPTCYP3A4RECQLTRPA1 | |
| SCHEMBL14882179 | 0.61 | TRPA1 (0.34) | MAPTCYP3A4RECQLTRPA1 |
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-2018142288-A1 | MUKAADIAL ACETATE ISOLATED FROM WARBURGIA SALUTARIS AND THE USE THEREOF AS AN ANTIMALARIAL | UNIVERSITY OF KWAZULU-NATAL (ZA) | 2018-08-09 | — | — | WO | disclosed |