Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 6/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | HSD11B1 | P28845 | 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 | |
|---|---|---|---|---|
| SCHEMBL25366788 | 0.81 | NR1H2 (0.38) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL21790284 | 0.81 | NR1H2 (0.38) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL29007853 | 0.81 | NR1H2 (0.39) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL20446616 | 0.80 | HSD17B10 (0.37) | CHRM2CHRM1CHRM3HDAC8EPHX2 | |
| SCHEMBL24021148 | 0.80 | HSD17B10 (0.37) | CHRM2CHRM1CHRM3HDAC8EPHX2 | |
| SCHEMBL21996654 | 0.80 | KLK7 (0.38) | NR1H2MEN1KMT2ATACR1 | |
| SCHEMBL703952 | 0.79 | NR1H2 (0.40) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL703953 | 0.79 | NR1H2 (0.40) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL17001728 | 0.79 | NR1H2 (0.40) | NR1H2CHRM2CHRM1CHRM3MEN1 | |
| SCHEMBL21996628 | 0.79 | PTPN1 (0.37) | NR1H2CHRM2CHRM1CHRM3HDAC8 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020113077-A9 | COMPOSITIONS AND METHODS FOR MODULAR CONTROL OF BIOORTHOGONAL LIGATION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-08-13 | — | — | WO | disclosed |
| WO-2020113077-A1 | COMPOSITIONS AND METHODS FOR MODULAR CONTROL OF BIOORTHOGONAL LIGATION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-06-04 | — | — | WO | disclosed |