Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CETP | P11597 | 11/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10196400 | 1.00 | LMNA (0.44) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL16258236 | 0.90 | LMNA (0.46) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL10196408 | 0.88 | LMNA (0.40) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL12424360 | 0.88 | LMNA (0.40) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL10196397 | 0.86 | CETP (0.45) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL12423364 | 0.86 | CETP (0.45) | LMNAGAAHTTCYP1A2CYP2C9 | |
| SCHEMBL10196407 | 0.84 | CETP (0.48) | LMNAGAAHTTCETP | |
| SCHEMBL12423601 | 0.84 | CETP (0.48) | LMNAGAAHTTCETP | |
| SCHEMBL10196402 | 0.84 | CETP (0.51) | CETP | |
| SCHEMBL662978 | 0.83 | PKM (0.41) | LMNAALDH1A1KDM4EHPGDCETP |
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-2011101424-A1 | TRICYCLIC PYRIDINE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PREPARATION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-25 | — | — | WO | disclosed |