Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 7/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | BCL2 | P10415 | 1/20 | 0.30 |
| ▸ | BCL2L1 | Q07817 | 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 | |
|---|---|---|---|---|
| SCHEMBL16693759 | 0.79 | APOBEC3A (0.38) | LPAR1SMN1; SMN2CCR1RAB9ACCR5 | |
| SCHEMBL21585395 | 0.76 | KMT2A (0.41) | MEN1KMT2AGRM5CYP1A2POLB | |
| SCHEMBL27885274 | 0.76 | TRPV1 (0.42) | LRRK2 | |
| SCHEMBL23458439 | 0.73 | CCNA2 (0.37) | MEN1KMT2AGRM5POLBLRRK2 | |
| SCHEMBL1840667 | 0.73 | MEN1 (0.36) | MEN1KMT2AGRM5CYP1A2POLB | |
| SCHEMBL29983687 | 0.73 | CCNA2 (0.37) | MEN1KMT2AGRM5POLBLRRK2 | |
| Acetonitrile SCHEMBL27976112 | 0.71 | TRPV1 (0.39) | MEN1KMT2ALRRK2 | |
| SCHEMBL4477938 | 0.70 | MKNK2 (0.42) | GRM5LRRK2 | |
| SCHEMBL1145111 | 0.69 | LMNA (0.48) | MEN1KMT2ACYP2D6LMNA | |
| SCHEMBL2547927 | 0.69 | MEN1 (0.40) | MEN1KMT2AGRM5CYP1A2POLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-102858742-B | Trpv1 vanilloid receptor antagonists with a bicyclic portion | PHARMESTE SRL | 2015-05-27 | — | — | CN | disclosed |
| CN-102858742-A | Trpv1 vanilloid receptor antagonists with a bicyclic portion | PHARMESTE SRL | 2013-01-02 | — | — | CN | disclosed |