Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 10/20 | 0.51 |
| ▸ | TMPRSS4 | Q9NRS4 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | TSPO | P30536 | 1/20 | 0.45 |
| ▸ | SMO | Q99835 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.40 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21394554 | 0.91 | MRGPRX1 (0.49) | MRGPRX1TMPRSS4TRPV1TSPOSMO | |
| SCHEMBL21394555 | 0.91 | MRGPRX1 (0.49) | MRGPRX1TMPRSS4TRPV1TSPOHRH1 | |
| SCHEMBL21384576 | 0.89 | MRGPRX1 (0.63) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL21394420 | 0.88 | MRGPRX1 (0.56) | MRGPRX1TMPRSS4TRPV1TSPOSMO | |
| SCHEMBL21394417 | 0.86 | MRGPRX1 (0.53) | MRGPRX1TMPRSS4TRPV1TSPOSMO | |
| SCHEMBL21394361 | 0.84 | MRGPRX1 (0.58) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL21381353 | 0.83 | MRGPRX1 (0.62) | MRGPRX1TMPRSS4TRPV1TSPOHRH1 | |
| SCHEMBL21384571 | 0.80 | MRGPRX1 (0.60) | MRGPRX1TMPRSS4TSPOHRH1MAPT | |
| SCHEMBL21394415 | 0.78 | MRGPRX1 (0.61) | MRGPRX1TMPRSS4TSPOHRH1 | |
| SCHEMBL25348663 | 0.78 | TMPRSS4 (0.62) | TMPRSS4TRPV1SMOCA12CA1 |
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-2019179436-A1 | ACID AMIDE COMPOUND AND USE THEREOF IN TREATMENT OF CANCERS | 成都海创药业有限公司 | 2019-09-26 | — | — | WO | disclosed |