Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 10/20 | 0.63 |
| ▸ | TMPRSS4 | Q9NRS4 | 3/20 | 0.51 |
| ▸ | TSPO | P30536 | 1/20 | 0.47 |
| ▸ | SMO | Q99835 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.46 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.46 |
| ▸ | IDH1 | O75874 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.45 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | CCR9 | P51686 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21394361 | 0.95 | MRGPRX1 (0.58) | MRGPRX1TMPRSS4TSPOSMOPPARG | |
| SCHEMBL21394417 | 0.91 | MRGPRX1 (0.53) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL21381353 | 0.90 | MRGPRX1 (0.62) | MRGPRX1TMPRSS4TSPOPPARGPPARD | |
| SCHEMBL21394415 | 0.89 | MRGPRX1 (0.61) | MRGPRX1TMPRSS4TSPOPPARGPPARD | |
| SCHEMBL21394560 | 0.89 | MRGPRX1 (0.51) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL18341272 | 0.88 | TMPRSS4 (0.54) | MRGPRX1TMPRSS4SMOPPARGPPARD | |
| SCHEMBL21384570 | 0.86 | TMPRSS4 (0.55) | MRGPRX1TMPRSS4SMOPPARGPPARD | |
| SCHEMBL21394420 | 0.86 | MRGPRX1 (0.56) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL21394554 | 0.86 | MRGPRX1 (0.49) | MRGPRX1TMPRSS4TSPOSMOCA12 | |
| SCHEMBL24481354 | 0.85 | TMPRSS4 (0.54) | MRGPRX1TMPRSS4SMOPPARGPPARD |
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-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 |
| 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 |