Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX1 | Q96LB2 | 11/20 | 0.60 |
| ▸ | TP53 | P04637 | 3/20 | 0.48 |
| ▸ | TSPO | P30536 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TMPRSS4 | Q9NRS4 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.42 |
| ▸ | SLC10A1 | Q14973 | 1/20 | 0.42 |
| ▸ | SLC10A6 | Q3KNW5 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21384613 | 0.93 | MRGPRX1 (0.61) | MRGPRX1TP53TSPOKDM4EMAPT | |
| SCHEMBL21394421 | 0.88 | MRGPRX1 (0.46) | MRGPRX1TP53TSPOKDM4EMAPT | |
| SCHEMBL21394400 | 0.85 | MRGPRX1 (0.44) | MRGPRX1TP53TSPOKDM4EMAPT | |
| SCHEMBL21384576 | 0.84 | MRGPRX1 (0.63) | MRGPRX1TSPOKDM4EHRH1TMPRSS4 | |
| SCHEMBL21381353 | 0.83 | MRGPRX1 (0.62) | MRGPRX1TSPOKDM4EMAPTRAB9A | |
| SCHEMBL21394560 | 0.80 | MRGPRX1 (0.51) | MRGPRX1TP53TSPOMAPTHRH1 | |
| SCHEMBL21394361 | 0.80 | MRGPRX1 (0.58) | MRGPRX1TSPOMAPTTMPRSS4 | |
| SCHEMBL21394415 | 0.78 | MRGPRX1 (0.61) | MRGPRX1TSPOHRH1TMPRSS4SLC10A6 | |
| SCHEMBL21394554 | 0.77 | MRGPRX1 (0.49) | MRGPRX1TP53TSPOMAPTRAB9A | |
| SCHEMBL21394417 | 0.76 | MRGPRX1 (0.53) | MRGPRX1TSPOHRH1TMPRSS4SLC10A2 |
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 |