Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 7/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28140496 | 0.81 | MEN1 (0.46) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL10385675 | 0.81 | MEN1 (0.66) | MEN1KMT2ACYP2D6OPRD1SLC6A4 | |
| SCHEMBL1855362 | 0.78 | CHRM2 (0.53) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL20884977 | 0.78 | CYP2D6 (0.49) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL27631913 | 0.78 | MEN1 (0.43) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL24556564 | 0.78 | CYP2D6 (0.44) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL15186926 | 0.78 | OPRD1 (0.49) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL18500800 | 0.78 | CYP2D6 (0.44) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL27858021 | 0.78 | MEN1 (0.43) | MEN1KMT2ACYP2D6CYP19A1OPRD1 | |
| SCHEMBL7447755 | 0.75 | MEN1 (0.79) | MEN1KMT2ACYP2D6CYP19A1OPRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1904498-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007004749-A1 | FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-01-11 | — | — | WO | disclosed |